Products for Research Use Only
RegisterLogin

2- (2-Bromophenyl) -2-methylpropanenitrile

CAT: 0926-HCA77506Size: 2.5 gDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0926-HCA77506Size:2.5 g
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
57775-06-1
MDL Number
MFCD11036582
Smiles
CC (C) (C#N) C1=CC=CC=C1Br
Molecular Formula
C10H10BrN
Molecular Weight
224.1 g/mol
Controlled
No

Chemical Information

2-(2-Bromophenyl)-2-methylpropanenitrile
CAS Number57775-06-1
PubChem CID12273136
IUPAC Name2-(2-bromophenyl)-2-methylpropanenitrile
Molecular FormulaC10H10BrN
Molecular Weight224.10
XLogP3.2
Topological Polar Surface Area23.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count12
Formal Charge0
Complexity201
SMILES
CC(C)(C#N)C1=CC=CC=C1Br
InChI
InChI=1S/C10H10BrN/c1-10(2,7-12)8-5-3-4-6-9(8)11/h3-6H,1-2H3
InChIKey
YTUDHLARHDCOIR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(2-Bromophenyl)-2-methylpropanenitrile
CAS: 57775-06-1
CID: 12273136
Formula: C10H10BrN
MW: 224.10
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight224.10
XLogP33.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass222.99966
Monoisotopic Mass222.99966
Topological Polar Surface Area23.8 Ų
Heavy Atom Count12
Formal Charge0
Complexity201
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
QDA433202- (3-Bromophenyl) -2-methylpropanenitrile
SLD34161-012-Isothiocyanato-2-methylpropanenitrile
ZYC19783-012-Cyclobutyl-2-methylpropanenitrile
PAA66829-012-Methanesulfonyl-2-Methylpropanenitrile
NAA52475-012- (2-Methoxyphenyl) -2-methylpropanenitrile
UCA84908-012- (2-chlorophenyl) -2-methylpropanenitrile
HAA17896-012- (1-Hydroxycyclohexyl) -2-methylpropanenitrile
TDA74809-012- (4-Fluorophenyl) -2-methylpropanenitrile
FBA56832-012- (4-Chlorophenyl) -2-methylpropanenitrile
DXB18796-012- (4-Bromobenzenesulfonyl) -2-methylpropanenitrile

Alternative Products

CatalogName
413087-012- (2-Bromophenyl) -2-methylpropanenitrile
OR1095793-012- (3-bromophenyl) -2-methylpropanenitrile
413657-012- (4-Bromophenyl) -2-methylpropanenitrile
259208-012-Amino-2-methylpropanenitrile
sc-340251A2- (dimethylamino) -2-methylpropanenitrile
sc-340232A2- (cyclopropylamino) -2-methylpropanenitrile
OR3039962- (Benzylamino) -2-methylpropanenitrile
RG-A262038-012-Bromo-2-Methylpropanenitrile
OR78493-012- (2-Methoxyphenyl) -2-methylpropanenitrile
sc-2740042- (isopropylamino) -2-methylpropanenitrile

Popular Products