200,000+ products from a single source!
sales@angenechem.com
Home > Bromides > 1261609-83-9
1261609-83-9 | Benzonitrile, 2-bromo-5-(hydroxymethyl)-
CAS No: 1261609-83-9 Catalog No: AG000RVB MDL No:MFCD18390752
Product Description
Catalog Number:
AG000RVB
Chemical Name:
Benzonitrile, 2-bromo-5-(hydroxymethyl)-
CAS Number:
1261609-83-9
Molecular Formula:
C8H6BrNO
Molecular Weight:
212.0433
MDL Number:
MFCD18390752
IUPAC Name:
2-bromo-5-(hydroxymethyl)benzonitrile
InChI:
InChI=1S/C8H6BrNO/c9-8-2-1-6(5-11)3-7(8)4-10/h1-3,11H,5H2
InChI Key:
QGKIDJKOPKESAI-UHFFFAOYSA-N
SMILES:
OCc1ccc(c(c1)C#N)Br
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.963g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
212.046g/mol
Monoisotopic Mass:
210.963g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
44A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.