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2-(3'-tert-Butyl-2'-hydroxy-5'-(2-methoxycarbonylethyl)phenyl)benzotriazole

HCID 93481
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
104810-48-2
Standard SMILES
COC(=O)CCc1cc(-n2nc3ccccc3n2)c(O)c(C(C)(C)C)c1
InChIKey
UJRDRFZCRQNLJM-UHFFFAOYSA-N
Molecular formula
C20H23N3O3
Average molar mass
353.4 g/mol
Monoisotopic mass
353.1739416

Names & identifiers

Preferred name
2-(3'-tert-Butyl-2'-hydroxy-5'-(2-methoxycarbonylethyl)phenyl)benzotriazole
IUPAC
methyl 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxyphenyl]propanoate
English name
Tinuvin-1130
Molecular formula
(C2H4O)nC19H21N3O3
Molecular weight
0

Names & synonyms

84268-33-7Benzenepropanoic acid, 3-(2H-benzotriazol-2-yl)-5-(1,1-dimethylethyl)-4-hydroxy-, methyl esterDTXSID90364882-(3'-tert-butyl-2'-hydroxy-5'-(2-methoxycarbonylethyl)phenyl)benzotriazoleRefChem:1060963DTXCID7016488Tinuvin 1130104810-48-2Methyl 3-(3-(2H-benzo[d][1,2,3]triazol-2-yl)-5-(tert-butyl)-4-hydroxyphenyl)propanoate102577-46-8UV-1130MFCD01743055
Show more names
UV5050UV 5151TINUVIN 213UV 1130 / Tinuvin-1130Tinuvin-1130 ISO 9001:2015 REACHTinuvin-1130Antioxidant 1130CHLUMILS UV 5151Light Stabilizer 5151
methyl 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxyphenyl]propanoate634MC97D37Methyl 3-(3-tert-butyl-5-(2H-benzotriazol-2-yl)-4-hydroxyphenyl)propionateMethyl 3-(2H-benzotriazol-2-yl)-5-tert-butyl-4-hydroxyhydrocinnamateMethyl 3-[3-(2H-Benzo[d][1,2,3]triazol-2-yl)-5-(tert-butyl)-4-hydroxyphenyl]propanoateSCHEMBL31360SCHEMBL29350844UNII-634MC97D37

Properties

Computed structural properties

XLogP
4.7
Topological polar surface area
77.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
26
Formal charge
0
Complexity
479

Experimental & physicochemical properties

Physical DescriptionOther Solid

Physicochemical properties

Boiling point
166 °C · 166 °C (0,011 kPa)
Density
1 · 1,17 g/cm3 (20 °C)
vapor pressure
0 · 0,0048 hPa (25 °C)
Flash point
218 °C · 218 °C
form
viscous liquid
color
light yellow to light amber
Odor
odourless
PH
6 · approx. 6,5 (10 g/l, 20 - 25 °C)
Water Solubility
0 · 0,0077 g/l (20 °C, 1.013 hPa)
Cosmetics Ingredients Functions
LIGHT STABILIZER
InChI
InChI=1S/C20H23N3O3/c1-20(2,3)14-11-13(9-10-18(24)26-4)12-17(19(14)25)23-21-15-7-5-6-8-16(15)22-23/h5-8,11-12,25H,9-10H2,1-4H3
InChIKey
UJRDRFZCRQNLJM-UHFFFAOYSA-N

Safety & regulation

GHS classification

GHS Classification · 6 items

This chemical does not meet GHS hazard criteria for 3.4% (16 of 473) of reports.

Warning

H317 (96.6%): May cause an allergic skin reaction [Warning Sensitization, Skin]

P261, P272, P273, P280, P302+P352, P321, P333+P317, P362+P364, P391, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 473 reports by companies from 11 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

This chemical does not meet GHS hazard criteria for 0.9% (1 of 112) of reports.

Hazard information

Regulatory Information · 6 items

Chemical: Poly(oxy-1,2-ethanediyl), .alpha.-[3-[3-(2H-benzotriazol-2-yl)-5-(1,1-dimethylethyl)-4-hydroxyphenyl]-1-oxopropyl]-.omega.-hydroxy-

Chemical: Benzenepropanoic acid, 3-(2H-benzotriazol-2-yl)-5-(1,1-dimethylethyl)-4-hydroxy-, methyl ester

Benzenepropanoic acid, 3-(2H-benzotriazol-2-yl)-5-(1,1-dimethylethyl)-4-hydroxy-, methyl ester is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Benzenepropanoic acid, 3-(2H-benzotriazol-2-yl)-5-(1,1-dimethylethyl)-4-hydroxy-, methyl ester are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

FRI - indicates a polymeric substance containing no free-radical initiator in its Inventory name but is considered to cover the designated polymer made with any free-radical initiator regardless of the amount used.

Status: Active Update: 05-10-2016 https://echa.europa.eu/registration-dossier/-/registered-dossier/16213

Hazard Classes and Categories · 3 items

Skin Sens. 1 (96.6%)

Aquatic Chronic 4 (99.1%)

Skin Sens. 1 (100%)

Safety data

tsca

Chemistry & industry

Uses & manufacturing

U.S. Production2023: 1,000,000 - <5,000,000 lb
Consumer UsesUV stabilizer
Industry UsesIntermediate
Household Products · 2 items

Information on 14 consumer products that contain Benzenepropanoic acid, 3-(2H-benzotriazol-2-yl)-5-(1,1-dimethylethyl)-4-hydroxy-, methyl ester in the following categories is provided:

Information on 29 consumer products that contain Poly(oxy-1,2-ethanediyl), alpha-(3-(3-(2H-benzotriazol-2-yl)-5-(1,1-dimethylethyl)-4-hydroxyphenyl)-1-oxopropyl)-omega-hydroxy- in the following categories is provided:

General Manufacturing Information · 3 items

All Other Basic Organic Chemical Manufacturing

Benzenepropanoic acid, 3-(2H-benzotriazol-2-yl)-5-(1,1-dimethylethyl)-4-hydroxy-, methyl ester: ACTIVE

Poly(oxy-1,2-ethanediyl), .alpha.-[3-[3-(2H-benzotriazol-2-yl)-5-(1,1-dimethylethyl)-4-hydroxyphenyl]-1-oxopropyl]-.omega.-hydroxy-: ACTIVE

Applications · 1 item

UsesTinuvin-1130 has good resistance to high temperature and anti-extraction properties. The product is particularly suitable for the field of industrial with high weather resistance requirements and automotive coatings, and it also provides adequate protection for woody sensitive substrates.

Suppliers100 total

北京华美互利生物化工010-56205725 · [email protected]
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
广州千汇环保科技有限公司

Related reactions

8 records
New reaction record
HRID 411938 reaction equation
HRID 411938As reactantuspto-grants-2003_05
HRID 433651 reaction equation
HRID 433651As reactantuspto-grants-2003_12
HRID 1493412 reaction equation
HRID 1493412As reactantuspto-grants-1991_06
HRID 1493413 reaction equation
HRID 1493413As reactantuspto-grants-1991_06
HRID 1541284 reaction equation
HRID 1541284As reactantTraining data from https://doi.org/10.1039/C8SC04228D (1/10)
HRID 1573887 reaction equation
HRID 1573887As reactantTraining data from https://doi.org/10.1039/C8SC04228D (1/10)
HRID 1582839 reaction equation
HRID 1582839As reactantuspto-grants-2004_05
HRID 2187306 reaction equation
HRID 2187306As reactantuspto-grants-2002_06

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes

Database identifiers

CAS
104810-48-2、84268-33-7
PubChem CID
93481
DTXSID
DTXSID9036488
UNII
634MC97D37
EC Number
400-820-2、600-603-4、672-710-4
Nikkaji
J661.254G
SMILES
C(OC)(=O)CCC1=CC(C(C)(C)C)=C(O)C(N2N=C3C=CC=CC3=N2)=C1
CAS DataBase Reference
104810 · 104810-48-2
EPA Substance Registry System
-3 · Polyethylene glycol mono-3-[3-(2H-benzotriazol-2-yl)-5-tert-butyl-4-hydroxyphenyl]-1-oxopropyl ether (104810-48-2)
Symbol(GHS)
7 · GHS07,GHS09
Signal word
Warning
Hazard statements
411 · H411-H317
Precautionary statements
261 · P261-P272-P280-P302+P352-P333+P313-P321-P363-P501
TSCA
TSCA listed
TSCA listed
Signal word
Warning
Symbol(GHS)
GHS07,GHS09
Hazard statements
H411-H317
Precautionary statements
P261-P272-P280-P302+P352-P333+P313-P321-P363-P501
15302211823 · [email protected]
Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]
湖北万得化工有限公司15377098680 15377098680 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
杭州景优化工有限公司87211835 13957193240 · [email protected]
河南赢创生物科技有限公司16650615803 · [email protected]
福建帝盛科技股份有限公司0571-88226505 17757185101 · [email protected]
江苏能越新材料科技有限公司13376001577 · [email protected]
天津中信凯泰化工有限公司022-66880623 · [email protected]
湖北兴琰新材料科技有限公司13129948835 · [email protected]
梯希爱(上海)化工贸易有限公司021-61109150 · [email protected]
上海钰康生物科技有限公司+86-18930848214 +86-021-56762820 · [email protected]
湖北广奥生物科技有限公司027-02702759223056 18162699093 · [email protected]
武汉丰泰威远科技有限公司027-87465837 19945049750 · [email protected]
湖北成海化工有限公司027-59220433 18327245847 · [email protected]
孝感深远化工有限公司15527621225; 15527621225 · [email protected]
Xiamen AmoyChem Co., Ltd+86-86-5926051114 · [email protected]
湖北恒化科技有限公司18064208139 · [email protected]
成都麦卡希化工有限公司028-85632863 18108198598 · [email protected]
青岛德达志成化工有限公司18766299236 · [email protected]
北京奥秘佳得医药科技有限公司+86-13522808617 · [email protected]
常州市阳光药业有限公司0519-83138357 , 13706121722 15906111278 · [email protected]
常州市尚科医药化工材料有限公司0519-85269522 15906111708 · [email protected]
上海御略医药科技有限公司021-60345187 13671753212 · [email protected]
常州市卓燊医药化工材料有限公司0519-85286950 15380036950 · [email protected]
湖北巨胜科技有限公司027-59599241 18871490274 · [email protected]
池州凯隆进出口贸易有限公司[email protected]
桦特昇生物科技(武汉)有限公司027-59207879 1972026995 18140587686 · [email protected]
Alfa Chemistry1-516-6625404 · [email protected]
湖北军瑞生物科技有限公司13971166412 · [email protected]
厦门志信化学有限公司+86-5922680277 +86-13806087780 · [email protected]
武汉欣扬瑞和化学科技有限公司13720181483 13720181483 · [email protected]
泰安嘉岳生物化工有限公司15318151873 · [email protected]
广东翁江化学试剂有限公司0751-2886766 13927870850 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
武汉匠信生物科技有限公司19272768272 18007157445 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
湖北源梦生物科技有限公司027-68897569 18120462897 · [email protected]
Qiuxian Baitai New Material Co., LTD+86-19932103556 · [email protected]
南京择优新材料科技有限公司173-40521416 17340521416 · [email protected]
上海炎泽化工有限公司15345144255 19901447308 · [email protected]
上海源叶生物科技有限公司13636370518 · [email protected]
湖北齐飞医药化工有限公司027-59322506 18071128681 · [email protected]
武汉克米克生物医药技术有限公司027-13163388153 13163388153 · [email protected]
河北克拉维尔生物科技有限公司19930503252 · [email protected]
青岛杰得佳新材料科技有限公司0532-68077006 13658692156 · [email protected]
青岛杰百奥助剂有限公司053268077006 17685522406 · [email protected]
武汉弘德悦欣医药科技有限公司027-83850116 18164090116 · [email protected]