200,000+ products from a single source!
sales@angenechem.com
515846-11-4 | 2-Bromo-4-isopropoxy-5-methoxybenzonitrile
CAS No: 515846-11-4 Catalog No: AG003GOG MDL No:MFCD02256815
Product Description
Catalog Number:
AG003GOG
Chemical Name:
2-Bromo-4-isopropoxy-5-methoxybenzonitrile
CAS Number:
515846-11-4
Molecular Formula:
C11H12BrNO2
Molecular Weight:
270.1225
MDL Number:
MFCD02256815
IUPAC Name:
2-bromo-5-methoxy-4-propan-2-yloxybenzonitrile
InChI:
InChI=1S/C11H12BrNO2/c1-7(2)15-11-5-9(12)8(6-13)4-10(11)14-3/h4-5,7H,1-3H3
InChI Key:
NGZGOZFFYWJHEG-UHFFFAOYSA-N
SMILES:
COc1cc(C#N)c(cc1OC(C)C)Br
Properties
Complexity:
248
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.005g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
270.126g/mol
Monoisotopic Mass:
269.005g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.