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Details

Stereochemistry ACHIRAL
Molecular Formula C9H9ClO2
Molecular Weight 184.62
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(Chloromethyl)-4-methoxybenzaldehyde

SMILES

COC1=C(CCl)C=C(C=O)C=C1

InChI

InChIKey=LNKDOOILNUKDMI-UHFFFAOYSA-N
InChI=1S/C9H9ClO2/c1-12-9-3-2-7(6-11)4-8(9)5-10/h2-4,6H,5H2,1H3

HIDE SMILES / InChI

Molecular Formula C9H9ClO2
Molecular Weight 184.62
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 19:33:38 GMT 2025
Edited
by admin
on Tue Apr 01 19:33:38 GMT 2025
Record UNII
EU3P5HP7UC
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Benzaldehyde, 3-(chloromethyl)-4-methoxy-
Preferred Name English
3-(Chloromethyl)-4-methoxybenzaldehyde
Systematic Name English
Code System Code Type Description
CAS
52577-09-0
Created by admin on Tue Apr 01 19:33:39 GMT 2025 , Edited by admin on Tue Apr 01 19:33:39 GMT 2025
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ECHA (EC/EINECS)
258-015-5
Created by admin on Tue Apr 01 19:33:39 GMT 2025 , Edited by admin on Tue Apr 01 19:33:39 GMT 2025
PRIMARY
PUBCHEM
104237
Created by admin on Tue Apr 01 19:33:39 GMT 2025 , Edited by admin on Tue Apr 01 19:33:39 GMT 2025
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FDA UNII
EU3P5HP7UC
Created by admin on Tue Apr 01 19:33:38 GMT 2025 , Edited by admin on Tue Apr 01 19:33:38 GMT 2025
PRIMARY
EPA CompTox
DTXSID2068769
Created by admin on Tue Apr 01 19:33:39 GMT 2025 , Edited by admin on Tue Apr 01 19:33:39 GMT 2025
PRIMARY