200,000+ products from a single source!
sales@angenechem.com
70275-61-5 | Cyclohexanecarboxylic acid, 3-phenylpropyl ester
CAS No: 70275-61-5 Catalog No: AG005KDP MDL No:
Product Description
Catalog Number:
AG005KDP
Chemical Name:
Cyclohexanecarboxylic acid, 3-phenylpropyl ester
CAS Number:
70275-61-5
Molecular Formula:
C16H22O2
Molecular Weight:
246.3447
IUPAC Name:
3-phenylpropyl cyclohexanecarboxylate
InChI:
InChI=1S/C16H22O2/c17-16(15-11-5-2-6-12-15)18-13-7-10-14-8-3-1-4-9-14/h1,3-4,8-9,15H,2,5-7,10-13H2
InChI Key:
HNNOWLIDJUXQBP-UHFFFAOYSA-N
SMILES:
O=C(C1CCCCC1)OCCCc1ccccc1
Properties
Complexity:
238
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.162g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
246.35g/mol
Monoisotopic Mass:
246.162g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.