HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

4,4'-Methylenebis(3-chloro-2,6-diethylaniline)

HCID 86261
NotesReactions
Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
106246-33-7
Standard SMILES
CCc1cc(Cc2cc(CC)c(N)c(CC)c2Cl)c(Cl)c(CC)c1N
InChIKey
VIOMIGLBMQVNLY-UHFFFAOYSA-N
Molecular formula
C21H28Cl2N2
Average molar mass
379.4 g/mol
Monoisotopic mass
378.1629543

Overview

See also: 4,4'-Methylene-bis-(3-chloro-2,6-diethylaniline) (annotation moved to); 4,4-Methylenebis-3-(chloro-2,6-diethyl)-aniline (annotation moved to).

Names & identifiers

Preferred name
4,4'-Methylenebis(3-chloro-2,6-diethylaniline)
IUPAC
4-[(4-amino-2-chloro-3,5-diethylphenyl)methyl]-3-chloro-2,6-diethylaniline
English name
Bis(4-amino-2-chloro-3,5-diethylphenyl)methane
Molecular formula
C21H28Cl2N2
Molecular weight
379.37

Names & synonyms

4,4'-Methylenebis(3-chloro-2,6-diethylaniline)Benzenamine, 4,4'-methylenebis[3-chloro-2,6-diethyl-Benzenamine, 4,4'-methylenebis(3-chloro-2,6-diethyl-DTXSID0073031VERSALINK MCDEAG Curing AgentRefChem:506802DTXCID9033006Benzenamine, 4,4'methylenebis(3chloro2,6diethyl106246-33-7bis(4-amino-2-chloro-3,5-diethylphenyl)methane4-[(4-amino-2-chloro-3,5-diethylphenyl)methyl]-3-chloro-2,6-diethylanilineM-CDEA
Show more names
LONZACURE(R) M-CDEA-GSJADEWIN MCDEALONZACURE(R) M-CDEALABOTEST-BB LT001593264,4'-METHYLENEBIS(3-CHLORO-2,6-DIETHYLAN4,4'-Methandiylbis(3-chlor-2,6-diethylanilin)4,4'-Methandiylbis(3-chlor-2,6-diethylanilin)
C21H28Cl2N2MFCD00071551GN49RAR5P24,4'-Methylenebis(3-chloro-2,6-diethylbenzenamine)4,4a(2)-Methylenebis[3-chloro-2,6-diethylbenzenamine]4-[(4-amino-2-chloro-3,5-diethylphenyl)methyl]-3-chloro-2,6-diethylphenylamine4,4'-Methylenebis[3-chloro-2,6-diethylbenzenamine]MCDEA

Properties

Computed structural properties

XLogP
6.9
Topological polar surface area
52 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
6
Heavy atoms
25
Formal charge
0
Complexity
369

Experimental & physicochemical properties

PolymersNitrogen Compounds -> Amines, Polyaromatic
Endocrine DisruptorsPotential endocrine disrupting compound
Physical Description · 2 items

Large Crystals

Off-white odorless granules; [Air Products MSDS]

Physicochemical properties

Melting point
88 °C · 88 °C
Boiling point
506.4 · 506.4±45.0 °C(Predicted)
Density
1.154 · 1.154±0.06 g/cm3(Predicted)
bulk density
610 · 610-650kg/m3
vapor pressure
0 Pa · 0Pa at 25℃
storage temp.
30 °C · Store below +30°C.
solubility
17000 in · 17000 in mg/100g standard fat at 20 ℃
form
powder to lump
pka
3.76 · 3.76±0.25(Predicted)

Safety & regulation

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

Hazard information

Regulatory Information · 4 items

Chemical: Benzenamine, 4,4'-methylenebis[3-chloro-2,6-diethyl-

Benzenamine, 4,4'-methylenebis[3-chloro-2,6-diethyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Benzenamine, 4,4'-methylenebis[3-chloro-2,6-diethyl- 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.

Benzenamine, 4,4'-methylenebis[3-chloro-2,6-diethyl-: Does not have an individual approval but may be used under an appropriate group standard

Hazards SummaryAn eye irritant; Targets the liver and reproductive system; A possible carcinogen; [Sigma-Aldrich MSDS] See 4,4'-Methylenedianiline and MBOCA.

Toxicology

Adverse EffectsOccupational hepatotoxin - Secondary hepatotoxins: the potential for toxic effect in the occupational setting is based on cases of poisoning by human ingestion or animal experimentation.

Safety data

wgk
WGK 3
tsca
TSCA listed
hs_code
2921.59.1700
Signal word
Warning
Symbol(GHS)
GHS07
Storage Class
11 - Combustible Solids
Hazard statements
H413
REACH Registrations
Active
Hazard Classifications
Aquatic Chronic 4

Chemistry & industry

Uses & manufacturing

U.S. Production2023: 101,567 lb
Industry UsesHardener
General Manufacturing Information · 2 items

Paint and Coating Manufacturing

Benzenamine, 4,4'-methylenebis[3-chloro-2,6-diethyl-: ACTIVE

Applications

UsesLONZACURE(R) M-CDEA is an excellent chain extender for elastomeric polyurethanes (PU) and also a curing agent for epoxides (EP). It provides improved mechanical and dynamic properties which cannot be achieved with standard formulations.

UsesLONZACURE(R) M-CDEA GS is the granulated version of LONZACURE(R) M-CDEA and therefore especially suitable for automatic feeding systems in production lines. It is an excellent chain extender for elastomeric polyurethanes (PU) and also.

Upstream & downstream products

Upstream raw materials

4,4'-Methylenebis(2,6-diethylaniline)Formaldehyde2,6-DiethylanilineHydrochloric acidHydrogen peroxide

Suppliers100 total

上海凌富药物研究有限公司+86(21)5895 0110 19945755304 · [email protected]
湖北威德利化学试剂有限公司

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

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

Database identifiers

CAS
106246-33-7
PubChem CID
86261
DTXSID
DTXSID0073031
UNII
GN49RAR5P2
Nikkaji
J726.035K
color
White to Light yellow to Light orange
Water Solubility
20 μg/L · 20μg/L at 20℃
InChI
InChI=1S/C21H28Cl2N2/c1-5-12-9-14(18(22)16(7-3)20(12)24)11-15-10-13(6-2)21(25)17(8-4)19(15)23/h9-10H,5-8,11,24-25H2,1-4H3
InChIKey
VIOMIGLBMQVNLY-UHFFFAOYSA-N
SMILES
C(C1=CC(CC)=C(N)C(CC)=C1Cl)C1=CC(CC)=C(N)C(CC)=C1Cl
LogP
6.5 at · 6.5 at 20℃
CAS DataBase Reference
106246 · 106246-33-7(CAS DataBase Reference)
FDA UNII
49 RAR5P2 · GN49RAR5P2
EPA Substance Registry System
4 · Benzenamine, 4,4'-methylenebis[3-chloro-2,6-diethyl- (106246-33-7)
UNSPSC Code
12352116 · 12352116
NACRES
22 · NA.22
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
413 · H413
Precautionary statements
501 · P501-P273
WGK Germany
3 · WGK 3
TSCA
TSCA listed
HS Code
2921.59 · 2921.59.1700
Storage Class
11 · 11 - Combustible Solids
Hazard Classifications
4 · Aquatic Chronic 4
REACH Registrations
Active
Precautionary statements
P501-P273
186-02735115 18062128043 · [email protected]
上海大然化学有限公司021-64478606 · [email protected]
河北创海生物科技有限公司+86-86-13131129325 · [email protected]
湖南嘉航医药科技有限公司85521272 18229978283 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Hebei Yanxi Chemical Co., Ltd.+86-17531190177 · [email protected]
江苏豪隆化工有限公司0513-89083520 13328092525 · [email protected]
毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
天津中信凯泰化工有限公司022-66880623 · [email protected]
武汉市聚舜化工有限公司027-02783261126 18971318572 · [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]
湖北长耀生物科技有限公司17683887209 17683887209 · [email protected]
苏州索森新材料科技有限公司18357035212 · [email protected]
张家港雅瑞化工有限公司0512-58961066 18921980669 · [email protected]
吉林中科研伸科技有限公司18143011203 · [email protected]
湖北健楚生物医药有限公司027-65528353 13554206703 · [email protected]
上海毕楷科技有限公司18516304666 · [email protected]
上海德茂化工有限公司+86-021-35121141 18019063037 · [email protected]
Xiamen AmoyChem Co., Ltd+86-86-5926051114 · [email protected]
张家港雅瑞化工有限公司0512-58961066 18921980669 · [email protected]
上海乔木化学科技有限公司021-60451683 15021268886 · [email protected]
艾科试剂4008-755-333 18080918076 · [email protected]
TCI AMERICA800-4238616 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
TCI Europe320-37350700 · [email protected]
武汉卡诺斯科技有限公司153-37111468 15337111468 · [email protected]
湖北鑫源顺医药化工有限公司13971561712, 13995564702, 027-50664929 · [email protected]
安徽科迪达化工有限公司0554-2106669 · [email protected]
上海笛柏生物科技有限公司400-008-9730,021-54359730 400-008-9730 · [email protected]
成都零六生物科技有限公司400-1166-196 13458535857 · [email protected]
上海麦克林生化科技股份有限公司15221275939 15221275939 · [email protected]
南京恰风和医药科技有限公司025-57018978 18251899859 · [email protected]
池州凯隆进出口贸易有限公司[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]
上海谱振生物科技有限公司4001650900 13817534909 · [email protected]
武汉峰耀同辉化学制品有限公司027-87466205 15377579727 · [email protected]
厦门志信化学有限公司+86-5922680277 +86-13806087780 · [email protected]
泰安嘉岳生物化工有限公司15318151873 · [email protected]
武汉沃轩科技有限公司13322067656 · [email protected]
安耐吉化学&3A(安徽泽升科技股份有限公司)400-0056266 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
上海大然化学有限公司021-64478606 15900664856 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
湖北阡陌生物科技有限公司0711-3812399 18062309155 · [email protected]
武汉克米克生物医药技术有限公司027-13163388153 13163388153 · [email protected]
常州合晶化工有限公司85528066 13775048983 · [email protected]