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3-chloro-N-(3,5-dimethoxyphenyl)propanamide

HCID 20118917
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Basic information

CAS
915923-51-2
Standard SMILES
COc1cc(NC(=O)CCCl)cc(OC)c1
InChIKey
FWJIKACTNJJWAJ-UHFFFAOYSA-N
Molecular formula
C11H14ClNO3
Average molar mass
243.68 g/mol
Monoisotopic mass
243.066221

Names & identifiers

Preferred name
3-chloro-N-(3,5-dimethoxyphenyl)propanamide
IUPAC
3-chloro-N-(3,5-dimethoxyphenyl)propanamide
English name
3-chloro-N-(3,5-dimethoxyphenyl)propanamide
Molecular formula
C11H14ClNO3
Molecular weight
243.69

Names & synonyms

3-chloro-N-(3,5-dimethoxyphenyl)propanamide915923-51-2MFCD08691976propanamide, 3-chloro-N-(3,5-dimethoxyphenyl)-DTXSID90602714ALBB-019000SBB108392AKOS000160267LS-06233CS-0316881H32792F075401
Show more names
UKRORGSYN-BB BBV-0479083-chloro-N-(3,5-dimethoxyphenyl)propionamide3-chloro-N-(3,5-dimethoxyphenyl)propanamide(SALTDATA: FREE)

Database identifiers

CAS
915923-51-2
PubChem CID
20118917
DTXSID
DTXSID90602714

Properties

Computed structural properties

XLogP
1.6
Topological polar surface area
47.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
5
Heavy atoms
16
Formal charge
0
Complexity
213

Physicochemical properties

Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
280 · P280-P305+P351+P338

Safety & regulation

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

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P280-P305+P351+P338

Related reactions

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Compound notes

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