N- (2-Chlorobenzyl) formamide

CAT: 0127-OR1062853-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1062853-01Size:250 mg

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CAS Number

86386-66-5

Purity

98%

Smiles

O=CNCC1=CC=CC=C1Cl

Chemical Information

N-(2-chlorobenzyl)formamide

CAS Number	86386-66-5
PubChem CID	13468186
IUPAC Name	N-[(2-chlorophenyl)methyl]formamide
Molecular Formula	C8H8ClNO
Molecular Weight	169.61
XLogP	1.7
Topological Polar Surface Area	29.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Heavy Atom Count	11
Formal Charge	0
Complexity	129

SMILES

C1=CC=C(C(=C1)CNC=O)Cl

InChI

InChI=1S/C8H8ClNO/c9-8-4-2-1-3-7(8)5-10-6-11/h1-4,6H,5H2,(H,10,11)

InChIKey

RUZYSHZMFLFLPF-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 86386-66-5

CID: 13468186

Formula: C8H8ClNO

MW: 169.61

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	169.61
XLogP3	1.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	169.0294416
Monoisotopic Mass	169.0294416
Topological Polar Surface Area	29.1 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	129
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
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OR27476	N- (2-Acetylphenyl) formamide
OR956972	N- (2-Chlorobenzyl) -N-ethylamine
OR1014102-01	N, N-Bis (2-Cyanoethyl) Formamide
OR1102441-01	N- (2,6-Dichlorophenyl) formamide
OR1027477-01	N- (Naphthalen-2-Yl) Formamide
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Catalog	Name
sc-235908	N- (2-Chlorophenyl) formamide
sc-235912	N- (2-Naphthyl) formamide
sc-255316	N- (2-Tolyl) formamide
sc-228656	N-2- (Bromophenyl) formamide
HAA41832-01	N- (2-Nitrophenyl) formamide
GBA35457	N-2-pyrimidinyl- Formamide
TRC-M336275-100MG	N-(2-Methoxy-2-methylpropyl)formamide
sc-474894	N-[2- (2-Thienyl) ethyl]formamide
TDA49376-01	N- (2- (Methylsulfonyl) phenyl) formamide
TRC-D476720-1G	N-(2,4-Dimethylphenyl)formamide