Home Other Building Blocks 4-(BROMOMETHYL)NAPHTHALENE-1-CARBONITRILE

4-(BROMOMETHYL)NAPHTHALENE-1-CARBONITRILE

CAS No.:
41014-20-4
Catalog Number:
AG00BYJG
Molecular Formula:
C12H8BrN
Molecular Weight:
246.1026
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
≥ 96% (HPLC)
1 week
United States
$243
- +
250mg
≥ 96% (HPLC)
1 week
United States
$439
- +
1g
≥ 96% (HPLC)
1 week
United States
$841
- +
Product Description
Catalog Number:
AG00BYJG
Chemical Name:
4-(BROMOMETHYL)NAPHTHALENE-1-CARBONITRILE
CAS Number:
41014-20-4
Molecular Formula:
C12H8BrN
Molecular Weight:
246.1026
MDL Number:
MFCD06658375
IUPAC Name:
4-(bromomethyl)naphthalene-1-carbonitrile
InChI:
InChI=1S/C12H8BrN/c13-7-9-5-6-10(8-14)12-4-2-1-3-11(9)12/h1-6H,7H2
InChI Key:
MFUZJLPIGYIBSM-UHFFFAOYSA-N
SMILES:
BrCc1ccc(c2c1cccc2)C#N
Properties
Complexity:
242  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.984g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
246.107g/mol
Monoisotopic Mass:
244.984g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties