200,000+ products from a single source!
sales@angenechem.com
25152-85-6 | 3-Hexen-1-ol, 1-benzoate, (3Z)-
CAS No: 25152-85-6 Catalog No: AG002QNP MDL No:MFCD00036526
Product Description
Catalog Number:
AG002QNP
Chemical Name:
3-Hexen-1-ol, 1-benzoate, (3Z)-
CAS Number:
25152-85-6
Molecular Formula:
C13H16O2
Molecular Weight:
204.2649
MDL Number:
MFCD00036526
IUPAC Name:
[(Z)-hex-3-enyl] benzoate
InChI:
InChI=1S/C13H16O2/c1-2-3-4-8-11-15-13(14)12-9-6-5-7-10-12/h3-7,9-10H,2,8,11H2,1H3/b4-3-
InChI Key:
BCOXBEHFBZOJJZ-ARJAWSKDSA-N
SMILES:
CC/C=C\CCOC(=O)c1ccccc1
EC Number:
246-669-4
UNII:
P4871S0YA9
FEMA Number:
3688
Properties
Complexity:
203
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
204.115g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.269g/mol
Monoisotopic Mass:
204.115g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.