N-((4-(chloromethyl)phenyl)methyl)acetamide

HCID 15550682

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 223512-41-2
Standard SMILES: CC(=O)NCc1ccc(CCl)cc1
InChIKey: UADHOMUWKSPYAI-UHFFFAOYSA-N
Molecular formula: C10H12ClNO
Average molar mass: 197.66 g/mol
Monoisotopic mass: 197.0607417

Names & identifiers

Preferred name: N-((4-(chloromethyl)phenyl)methyl)acetamide
IUPAC: N-[[4-(chloromethyl)phenyl]methyl]acetamide

Names & synonyms

223512-41-2N-{[4-(chloromethyl)phenyl]methyl}acetamideN-[[4-(chloromethyl)phenyl]methyl]acetamideN-((4-(chloromethyl)phenyl)methyl)acetamideRefChem:823020834-131-7N-(4-chloromethylphenylmethyl)acetamideN-(4-(Chloromethyl)benzyl)acetamideSCHEMBL5987795UADHOMUWKSPYAI-UHFFFAOYSA-NYIA51241N-(4-chloromethylphenylmethyl) acetamide

Show more names

N-(4-chloromethylphenylmethyl)-acetamideDB-125477EN300-2896061

Database identifiers

CAS: 223512-41-2
PubChem CID: 15550682
EC Number: 834-131-7
Nikkaji: J1.312.340C

Properties

Computed structural properties

XLogP: 1.3
Topological polar surface area: 29.1 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 3
Heavy atoms: 13
Formal charge: 0
Complexity: 164

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.