200,000+ products from a single source!
sales@angenechem.com
102-13-6 | Benzeneacetic acid, 2-methylpropyl ester
CAS No: 102-13-6 Catalog No: AG000682 MDL No:MFCD00026482
Product Description
Catalog Number:
AG000682
Chemical Name:
Benzeneacetic acid, 2-methylpropyl ester
CAS Number:
102-13-6
Molecular Formula:
C12H16O2
Molecular Weight:
192.2542
MDL Number:
MFCD00026482
IUPAC Name:
2-methylpropyl 2-phenylacetate
InChI:
InChI=1S/C12H16O2/c1-10(2)9-14-12(13)8-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3
InChI Key:
RJASFPFZACBKBE-UHFFFAOYSA-N
SMILES:
CC(COC(=O)Cc1ccccc1)C
EC Number:
203-007-9
UNII:
2QK898564G
NSC Number:
6602
FEMA Number:
2210
Properties
Complexity:
169
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.115g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.258g/mol
Monoisotopic Mass:
192.115g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.