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N-Propyl 4-fluorobenzamide

HCID 4589797
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Basic informationNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes
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Basic information

CAS
349129-65-3
Standard SMILES
CCCNC(=O)c1ccc(F)cc1
InChIKey
JKUGHIBZJGKKTQ-UHFFFAOYSA-N
Molecular formula
C10H12FNO
Average molar mass
181.21 g/mol
Monoisotopic mass
181.09029217

Names & identifiers

Preferred name
N-Propyl 4-fluorobenzamide
IUPAC
4-fluoro-N-propylbenzamide
English name
4-Fluoro-N-propylbenzamide
Molecular formula
C10H12FNO
Molecular weight
181.21

Names & synonyms

4-fluoro-N-propylbenzamideN-PROPYL 4-FLUOROBENZAMIDE349129-65-3MFCD012141374-fluoro-N-propyl-benzamideSCHEMBL8349985SCHEMBL9900386Benzamide, 4-fluoro-N-propyl-DTXSID40404629JKUGHIBZJGKKTQ-UHFFFAOYSA-NN-PROPYL-4-FLUOROBENZAMIDEAKOS003871863
Show more names
4-Fluoro-N-n-propylbenzaMide, 97%
AS-30406DB-371622CS-0211721F325415

Database identifiers

CAS
349129-65-3
PubChem CID
4589797
DTXSID
DTXSID40404629

Properties

Computed structural properties

XLogP
2
Topological polar surface area
29.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
13
Formal charge
0
Complexity
164

Physicochemical properties

Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302
Precautionary statements
280 · P280-P305+P351+P338
Hazard Codes
Xn
Risk Statements
22 · 22
WGK Germany
3 · 3
HS Code
2924297099 · 2924297099

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

wgk
3
hs_code
2924297099
risk_code
22
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xn
Hazard statements
H302
Precautionary statements
P280-P305+P351+P338

Related reactions

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Compound notes

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