HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Compound

N-Benzyl-4-chloro-N-methylbenzamide

HCID 306478
New noteNew reactionRequest quotes
Print preview
Basic informationNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
137374-28-8
Standard SMILES
CN(Cc1ccccc1)C(=O)c1ccc(Cl)cc1
InChIKey
XGUKOPOXWOJRCH-UHFFFAOYSA-N
Molecular formula
C15H14ClNO
Average molar mass
259.73 g/mol
Monoisotopic mass
259.0763918

Names & identifiers

Preferred name
N-Benzyl-4-chloro-N-methylbenzamide
IUPAC
N-benzyl-4-chloro-N-methylbenzamide
English name
N-Benzyl-4-chloro-N-MethylbenzaMide, 97%
Molecular formula
C15H14ClNO
Molecular weight
259.73

Names & synonyms

N-benzyl-4-chloro-N-methylbenzamide137374-28-8RefChem:829172653-962-4N-Benzyl-4-chloro-N-MethylbenzaMide, 97per centNSC204158MFCD00018684AKOS017050976NSC-204158ST50444613(4-chlorophenyl)-N-methyl-N-benzylcarboxamideN-Benzyl-4-chloro-N-MethylbenzaMide, 97%
Show more names
4-Chloro-N-methyl-N-(phenylmethyl)benzamideBenzamide, 4-chloro-N-methyl-N-(phenylmethyl)-

Database identifiers

CAS
137374-28-8
PubChem CID
306478
EC Number
653-962-4
Nikkaji
J424.510E

Properties

Computed structural properties

XLogP
3.5
Topological polar surface area
20.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
3
Heavy atoms
18
Formal charge
0
Complexity
268

Physicochemical properties

Melting point
202 · 202-203 °C
Boiling point
424.6 · 424.6±38.0 °C(Predicted)
Density
1.194 · 1.194±0.06 g/cm3(Predicted)
pka
-1.45 · -1.45±0.70(Predicted)
Symbol(GHS)
7 · GHS07,GHS09
Signal word
Warning
Hazard statements
302 · H302-H317-H400
Precautionary statements
261 · P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P273-P391-P501-P264-P270-P301+P312-P330-P501

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P270, P272, P273, P280, P301+P317, P302+P352, P321, P330, P333+P317, P362+P364, P391, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Safety data

Signal word
Warning
Symbol(GHS)
GHS07,GHS09
Hazard statements
H302-H317-H400
Precautionary statements
P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P273-P391-P501-P264-P270-P301+P312-P330-P501

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes
More actions
New noteNew reactionRequest quotes