N- (4-Bromophenyl) -N-methylacetamide

CAT: 0127-OR1052409-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1052409-01Size:250 mg

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CAS Number

50438-47-6

MDL Number

MFCD00094195

Purity

95%

Smiles

CC(N(C1=CC=C(Br)C=C1)C)=O

Chemical Information

N-(4-bromophenyl)-N-methylacetamide

CAS Number	50438-47-6
PubChem CID	4324567
IUPAC Name	N-(4-bromophenyl)-N-methylacetamide
Molecular Formula	C9H10BrNO
Molecular Weight	228.09
XLogP	1.7
Topological Polar Surface Area	20.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Heavy Atom Count	12
Formal Charge	0
Complexity	164

SMILES

CC(=O)N(C)C1=CC=C(C=C1)Br

InChI

InChI=1S/C9H10BrNO/c1-7(12)11(2)9-5-3-8(10)4-6-9/h3-6H,1-2H3

InChIKey

JDWFXKUASRMYEO-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 50438-47-6

CID: 4324567

Formula: C9H10BrNO

MW: 228.09

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	228.09
XLogP3	1.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	226.99458
Monoisotopic Mass	226.99458
Topological Polar Surface Area	20.3 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	164
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
OR907627-01	2- (4-Bromophenyl) -N-methylacetamide
OR22594-01	N- (4-Aminophenyl) -N-methylacetamide
OR93681	N-Methylacetamide
OR1589	N- (2,4-Dichlorophenyl) -N-methylacetamide
OR1002718-01	N-[4- (Methanesulfonamido) phenyl]-N-methylacetamide
OR1041219-01	2- (4-Methoxyphenyl) -N-methylacetamide
OR1053484-01	2- (4-Bromophenoxy) -N-methylacetamide
OR95255-01	2- (4-Hydroxyphenyl) -N-methylacetamide
OR1047829-01	N- (4-Bromo-3-chlorophenyl) -N-methylacetamide
OR1062944-01	N-Methoxy-2- (4-methoxyphenyl) -N-methylacetamide

Catalog	Name
sc-298094A	2- (4-Bromophenyl) -N-methylacetamide
413093-01	2- (2-Bromophenyl) -N-methylacetamide
sc-355399A	N-{[5- (4-bromophenyl) -2-furyl]methyl}-2-chloro-N-methylacetamide
sc-301204	N- (4-Aminophenyl) -N-methylacetamide
FH133574	N- (4-Hydroxyphenyl) -N-methylacetamide
sc-355294A	N-[4- (chloroacetyl) benzyl]-N-methylacetamide
JBA92145-01	2- (4-Hydroxyphenoxy) -N-methylacetamide
HBA63762-01	2- (4-Aminophenyl) -N-methylacetamide
CCA54748-01	2- (4-Aminophenoxy) -N-methylacetamide
EDA14959-01	2- (4-cyanophenyl) -N-methylacetamide