200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 5203-14-5
5203-14-5 | 4-Butoxybenzonitrile
CAS No: 5203-14-5 Catalog No: AG003LTC MDL No:MFCD00043482
Product Description
Catalog Number:
AG003LTC
Chemical Name:
4-Butoxybenzonitrile
CAS Number:
5203-14-5
Molecular Formula:
C11H13NO
Molecular Weight:
175.2270
MDL Number:
MFCD00043482
IUPAC Name:
4-butoxybenzonitrile
InChI:
InChI=1S/C11H13NO/c1-2-3-8-13-11-6-4-10(9-12)5-7-11/h4-7H,2-3,8H2,1H3
InChI Key:
RRGQINKVTNAIBB-UHFFFAOYSA-N
SMILES:
CCCCOc1ccc(cc1)C#N
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.1g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
175.231g/mol
Monoisotopic Mass:
175.1g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.