3,3'-DIMETHYLDIPHENYL METHANE-4,4'-DIISOCYANATE

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Details

Stereochemistry	ACHIRAL
Molecular Formula	C17H14N2O2
Molecular Weight	278.3053
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	2
Charge	0

SHOW SMILES / InChI

Structure of 3,3'-DIMETHYLDIPHENYL METHANE-4,4'-DIISOCYANATE

Structure Search

SMILES

CC1=CC(CC2=CC(C)=C(C=C2)N=C=O)=CC=C1N=C=O

InChI

InChIKey=DTZHXCBUWSTOPO-UHFFFAOYSA-N

InChI=1S/C17H14N2O2/c1-12-7-14(3-5-16(12)18-10-20)9-15-4-6-17(19-11-21)13(2)8-15/h3-8H,9H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C17H14N2O2
Molecular Weight	278.3053
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	2
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:07:57 GMT 2025` Edited by `admin` on `Mon Mar 31 22:07:57 GMT 2025`
Record UNII	3D7H11TIK1
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-84203

Preferred Name

English

3,3'-DIMETHYLDIPHENYL METHANE-4,4'-DIISOCYANATE

Common Name

English

Code System Code Type Description

PUBCHEM

61090

Created by admin on Mon Mar 31 22:07:57 GMT 2025 , Edited by admin on Mon Mar 31 22:07:57 GMT 2025

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EPA CompTox

DTXSID3044548

Created by admin on Mon Mar 31 22:07:57 GMT 2025 , Edited by admin on Mon Mar 31 22:07:57 GMT 2025

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NSC

84203

Created by admin on Mon Mar 31 22:07:57 GMT 2025 , Edited by admin on Mon Mar 31 22:07:57 GMT 2025

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FDA UNII

3D7H11TIK1

Created by admin on Mon Mar 31 22:07:57 GMT 2025 , Edited by admin on Mon Mar 31 22:07:57 GMT 2025

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CAS

139-25-3

Created by admin on Mon Mar 31 22:07:57 GMT 2025 , Edited by admin on Mon Mar 31 22:07:57 GMT 2025

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