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Details

Stereochemistry ACHIRAL
Molecular Formula C11H11Cl3N2O4
Molecular Weight 341.575
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3,4,6-Trichloro-2-nitrophenyl n-butylcarbamate

SMILES

CCCCNC(=O)OC1=C(Cl)C=C(Cl)C(Cl)=C1[N+]([O-])=O

InChI

InChIKey=GUAGVYQTSIEQQY-UHFFFAOYSA-N
InChI=1S/C11H11Cl3N2O4/c1-2-3-4-15-11(17)20-10-7(13)5-6(12)8(14)9(10)16(18)19/h5H,2-4H2,1H3,(H,15,17)

HIDE SMILES / InChI

Molecular Formula C11H11Cl3N2O4
Molecular Weight 341.575
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 19:48:50 GMT 2025
Edited
by admin
on Tue Apr 01 19:48:50 GMT 2025
Record UNII
7G5E2HY6G9
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3,4,6-Trichloro-2-nitrophenyl n-butylcarbamate
Systematic Name English
NSC-202937
Preferred Name English
PHENOL, 6-NITRO-2,4,5-TRICHLORO-, BUTYLCARBAMATE
Systematic Name English
Carbamic acid, butyl-, 3,4,6-trichloro-2-nitrophenyl ester
Common Name English
Code System Code Type Description
FDA UNII
7G5E2HY6G9
Created by admin on Tue Apr 01 19:48:50 GMT 2025 , Edited by admin on Tue Apr 01 19:48:50 GMT 2025
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CAS
14572-53-3
Created by admin on Tue Apr 01 19:48:50 GMT 2025 , Edited by admin on Tue Apr 01 19:48:50 GMT 2025
PRIMARY
PUBCHEM
99246
Created by admin on Tue Apr 01 19:48:50 GMT 2025 , Edited by admin on Tue Apr 01 19:48:50 GMT 2025
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NSC
202937
Created by admin on Tue Apr 01 19:48:50 GMT 2025 , Edited by admin on Tue Apr 01 19:48:50 GMT 2025
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EPA CompTox
DTXSID10932681
Created by admin on Tue Apr 01 19:48:50 GMT 2025 , Edited by admin on Tue Apr 01 19:48:50 GMT 2025
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