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(Diethoxymethoxy)benzene

HCID 84440
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
14444-77-0
Standard SMILES
CCOC(OCC)Oc1ccccc1
InChIKey
QTURWMMVIIBRRP-UHFFFAOYSA-N
Molecular formula
C11H16O3
Average molar mass
196.24 g/mol
Monoisotopic mass
196.10994437

Names & identifiers

Preferred name
(Diethoxymethoxy)benzene
IUPAC
diethoxymethoxybenzene
English name
DIETHYL PHENYL ORTHOFORMATE
Molecular formula
C11H16O3
Molecular weight
196.24

Names & synonyms

(Diethoxymethoxy)benzene14444-77-0Benzene, (diethoxymethoxy)-EINECS 238-421-9DTXSID10162709RefChem:406138DTXCID4085200238-421-9Diethyl phenyl orthoformatediethoxymethoxybenzenediethoxymethoxy-benzeneMFCD00009228
Show more names
SKL092DiethylPhenylOrthoformate>DIETHYL PHENYL ORTHOFORMATE, 98+%DIETHYL PHENYL ORTHOFORMATE, 97+%Diethoxy(phenoxy)methane Orthoformic Acid Diethyl Phenyl Ester
DiethoxyphenoxymethaneDiethoxy(phenoxy)methaneOrthoformic Acid Diethyl Phenyl Ester(Diethoxymethoxy)-benzene(Diethoxymethoxy)benzene #6WEU8V83SGDIETHYLPHENYLORTHOFORMATESCHEMBL4865190

Database identifiers

CAS
14444-77-0
PubChem CID
84440
DTXSID
DTXSID10162709
UNII
6WEU8V83SG
EC Number
238-421-9
Nikkaji
J208.822C

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
27.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
6
Heavy atoms
14
Formal charge
0
Complexity
126

Experimental & physicochemical properties

SpringerMaterials PropertiesOptical coefficient

Physicochemical properties

Melting point
-26 °C · -26°C
Boiling point
103 · 103-104 °C/10 mmHg (lit.)
Density
1.014 g/mL · 1.014 g/mL at 25 °C (lit.)
refractive index
20 · n20/D 1.480(lit.)
Flash point
135 °F · 135 °F
solubility
2 O; · insol cold H2O; sol most organic solvent
form
clear liquid
color
Colorless to Almost colorless
Sensitive
Moisture Sensitive
BRN
1872634 · 1872634
InChI
1S/C11H16O3/c1-3-12-11(13-4-2)14-10-8-6-5-7-9-10/h5-9,11H,3-4H2,1-2H3
InChIKey
QTURWMMVIIBRRP-UHFFFAOYSA-N

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)

Aggregated GHS information provided per 44 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Regulatory Information(Diethoxymethoxy)benzene: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

F
21
PPE
Eyeshields, Gloves, type ABEK (EN14387) respirator filter
wgk
3
ridadr
3272
hs_code
2909.19.6000
risk_code
36/38
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi
safety_code
26-36
hazard_class
3.2
Storage Class
10 - Combustible liquids
packing_group
III
Hazard statements

Chemistry & industry

Applications

UsesDiethyl Phenyl Orthoformate is used for mixed orthoformate which undergoes monosubstitution with Grignard reagents and other organometallic reagents to give diethyl acetals.

Upstream & downstream products

Downstream products

4,4-Diethoxy-N,N-dimethyl-1-butanamineISOBUTYRALDEHYDE DIETHYL ACETAL

Suppliers28 total

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
重庆欣博曜生物科技有限公司19122915778 · [email protected]
陕西缔都化学有限公司029-029-81123119 17391733320 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Aladdin Scientific[email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
阿法埃莎(中国)化学有限公司400-6106006 · [email protected]

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
SMILES
CCOC(OCC)Oc1ccccc1
CAS DataBase Reference
14444 · 14444-77-0
FDA UNII
6 WEU8V83SG · 6WEU8V83SG
UNSPSC Code
12352100 · 12352100
NACRES
22 · NA.22
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
315 · H315-H319
Precautionary statements
264 · P264-P280-P302+P352-P305+P351+P338-P332+P313-P337+P313
PPE
Eyeshields, Gloves, type ABEK (EN14387) respirator filter
Hazard Codes
Xi
Risk Statements
36 · 36/38
Safety Statements
26 · 26-36
RIDADR
3272 · 3272
WGK Germany
3 · 3
F
21 · 21
HS Code
2909.19 · 2909.19.6000
HazardClass
3.2 · 3.2
PackingGroup
III
Storage Class
10 · 10 - Combustible liquids
Hazard Classifications
2 Skin · Eye Irrit. 2Skin Irrit. 2
H315-H319
Hazard Classifications
Eye Irrit. 2Skin Irrit. 2
Precautionary statements
P264-P280-P302+P352-P305+P351+P338-P332+P313-P337+P313
安耐吉化学&3A(安徽泽升科技股份有限公司)400-0056266 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
山东西亚化学有限公司13355009207 13355009207 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
TCI AMERICA800-4238616 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
TCI Europe320-37350700 · [email protected]
洛阳佳得康化工科技有限公司16668001218 · [email protected]
上海喀露蓝科技有限公司18149758185 18149758185 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
Henan Alfa Chemical Co., Ltd+8618339805032 · [email protected]
广东翁江化学试剂有限公司0751-2886766 13927870850 · [email protected]
上海麦克林生化科技股份有限公司50706066 15221275939 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
TCI Chemicals (India) Pvt. Ltd.[email protected]
Aromsyn Co., Ltd.+86-0571-85585865 +86-13336024896 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]