4-Fluorobenzamide

CAT: 0572-TRC-F596793-500MGSize: 500 mgDry Ice: NoHazardous: No

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CAT#:0572-TRC-F596793-500MGSize:500 mg

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CAS Number

824-75-9

Hazard Statement

No Data Available

Smiles

NC(=O)c1ccc(F)cc1

Molecular Formula

C7H6FNO

Molecular Weight

139.13

Shipping Conditions

Room Temperature

Chemical Information

4-Fluorobenzamide

structure in first source

CAS Number	824-75-9
PubChem CID	71572
IUPAC Name	4-fluorobenzamide
Molecular Formula	C7H6FNO
Molecular Weight	139.13
XLogP	0.9
Topological Polar Surface Area	43.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	10
Formal Charge	0
Complexity	130

SMILES

C1=CC(=CC=C1C(=O)N)F

InChI

InChI=1S/C7H6FNO/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,(H2,9,10)

InChIKey

VNDHYTGVCGVETQ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 824-75-9

CID: 71572

Formula: C7H6FNO

MW: 139.13

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	139.13
XLogP3	0.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	139.043341977
Monoisotopic Mass	139.043341977
Topological Polar Surface Area	43.1 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	130
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
TRC-B680315-1G	4-Bromo-2-fluorobenzamide
TRC-B680315-10G	4-Bromo-2-fluorobenzamide
TRC-B680315-5G	4-Bromo-2-fluorobenzamide
TRC-D625125-1G	2,4-Dibromo-5-fluorobenzamide
TRC-F598015-100MG	2-Fluorobenzamide
TRC-F598015-1G	2-Fluorobenzamide
TRC-F598015-500MG	2-Fluorobenzamide
P482015	N-(Piperidin-4-yl)methyl-3-chloro-5-fluorobenzamide
TRC-P400985-100MG	N-Phenyl 2-Bromo-5-Fluorobenzamide
TRC-P400985-500MG	N-Phenyl 2-Bromo-5-Fluorobenzamide

Catalog	Name
sc-261958	4-Fluorobenzamide
432443-01	4-Fluorobenzamide-D4
430979-01	4-Bromo-3-fluorobenzamide
415118-01	2-Amino-4-fluorobenzamide
sc-301328	N-Cyclopropyl 4-fluorobenzamide
sc-289937	4-Borono-3-fluorobenzamide
PC1004126-01	4-Cyclopropyl-2-fluorobenzamide
sc-298939A	3-Bromo-4-fluorobenzamide
PC302107-01	4-Chloro-3-fluorobenzamide
PC901487-01	N-Ethyl 4-fluorobenzamide