ORTHO-CHLORAMBUCIL

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C14H19Cl2NO2
Molecular Weight	304.212
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ORTHO-CHLORAMBUCIL

Structure Search

SMILES

OC(=O)CCCC1=C(C=CC=C1)N(CCCl)CCCl

InChI

InChIKey=JLERWRRRDFUKIT-UHFFFAOYSA-N

InChI=1S/C14H19Cl2NO2/c15-8-10-17(11-9-16)13-6-2-1-4-12(13)5-3-7-14(18)19/h1-2,4,6H,3,5,7-11H2,(H,18,19)

HIDE SMILES / InChI

Molecular Formula	C14H19Cl2NO2
Molecular Weight	304.212
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 `Mon Mar 31 21:24:48 GMT 2025` Edited by `admin` on `Mon Mar 31 21:24:48 GMT 2025`
Record UNII	XL3657PT9U
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-43430

Preferred Name

English

ORTHO-CHLORAMBUCIL

Common Name

English

4-(2-(BIS(2-CHLOROETHYL)AMINO)PHENYL)BUTANOIC ACID

Systematic Name

English

CHLORAMBUCIL IMPURITY G, ORTHO-CHLORAMBUCIL-

Common Name

English

BENZENEBUTANOIC ACID, 2-(BIS(2-CHLOROETHYL)AMINO)-

Common Name

English

BUTYRIC ACID, 4-(O-(BIS(2-CHLOROETHYL)AMINO)PHENYL)-

Common Name

English

Code System Code Type Description

FDA UNII

XL3657PT9U

Created by admin on Mon Mar 31 21:24:48 GMT 2025 , Edited by admin on Mon Mar 31 21:24:48 GMT 2025

PRIMARY

EPA CompTox

DTXSID90170488

Created by admin on Mon Mar 31 21:24:48 GMT 2025 , Edited by admin on Mon Mar 31 21:24:48 GMT 2025

PRIMARY

NSC

43430

Created by admin on Mon Mar 31 21:24:48 GMT 2025 , Edited by admin on Mon Mar 31 21:24:48 GMT 2025

PRIMARY

PUBCHEM

238870

Created by admin on Mon Mar 31 21:24:48 GMT 2025 , Edited by admin on Mon Mar 31 21:24:48 GMT 2025

PRIMARY

CAS

178481-89-5

Created by admin on Mon Mar 31 21:24:48 GMT 2025 , Edited by admin on Mon Mar 31 21:24:48 GMT 2025

PRIMARY

Related Record Type Details


					18D0SL7309

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