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Details

Stereochemistry ACHIRAL
Molecular Formula C10H12ClNO
Molecular Weight 197.661
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-[(2-Chloroethyl)methylamino]benzaldehyde

SMILES

CN(CCCl)C1=CC=C(C=O)C=C1

InChI

InChIKey=IYFULQJDHJGQKQ-UHFFFAOYSA-N
InChI=1S/C10H12ClNO/c1-12(7-6-11)10-4-2-9(8-13)3-5-10/h2-5,8H,6-7H2,1H3

HIDE SMILES / InChI

Molecular Formula C10H12ClNO
Molecular Weight 197.661
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 19:22:00 GMT 2025
Edited
by admin
on Tue Apr 01 19:22:00 GMT 2025
Record UNII
C9U2A67KF3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-[(2-Chloroethyl)methylamino]benzaldehyde
Systematic Name English
Benzaldehyde, 4-[(2-chloroethyl)methylamino]-
Preferred Name English
4-(N-2-Chloroethyl-N-methylamino)benzaldehyde
Systematic Name English
Code System Code Type Description
FDA UNII
C9U2A67KF3
Created by admin on Tue Apr 01 19:22:00 GMT 2025 , Edited by admin on Tue Apr 01 19:22:00 GMT 2025
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CAS
94-31-5
Created by admin on Tue Apr 01 19:22:00 GMT 2025 , Edited by admin on Tue Apr 01 19:22:00 GMT 2025
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EPA CompTox
DTXSID6059100
Created by admin on Tue Apr 01 19:22:00 GMT 2025 , Edited by admin on Tue Apr 01 19:22:00 GMT 2025
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ECHA (EC/EINECS)
202-321-3
Created by admin on Tue Apr 01 19:22:00 GMT 2025 , Edited by admin on Tue Apr 01 19:22:00 GMT 2025
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PUBCHEM
66745
Created by admin on Tue Apr 01 19:22:00 GMT 2025 , Edited by admin on Tue Apr 01 19:22:00 GMT 2025
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