200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 17653-93-9
17653-93-9 | Benzeneacetonitrile, 3-methoxy-α,α-dimethyl-
CAS No: 17653-93-9 Catalog No: AG0024RD MDL No:MFCD09414739
Product Description
Catalog Number:
AG0024RD
Chemical Name:
Benzeneacetonitrile, 3-methoxy-α,α-dimethyl-
CAS Number:
17653-93-9
Molecular Formula:
C11H13NO
Molecular Weight:
175.2270
MDL Number:
MFCD09414739
IUPAC Name:
2-(3-methoxyphenyl)-2-methylpropanenitrile
InChI:
InChI=1S/C11H13NO/c1-11(2,8-12)9-5-4-6-10(7-9)13-3/h4-7H,1-3H3
InChI Key:
YMUMJIHZRRIBPK-UHFFFAOYSA-N
SMILES:
N#CC(c1cccc(c1)OC)(C)C
Properties
Complexity:
213
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:
2
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.