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119242-59-0 | 2-Penten-1-ol, 4-(phenylmethoxy)-, (2E,4S)-
CAS No: 119242-59-0 Catalog No: AG000IFA MDL No:
Product Description
Catalog Number:
AG000IFA
Chemical Name:
2-Penten-1-ol, 4-(phenylmethoxy)-, (2E,4S)-
CAS Number:
119242-59-0
Molecular Formula:
C12H16O2
Molecular Weight:
192.2542
IUPAC Name:
4-phenylmethoxypent-2-en-1-ol
InChI:
InChI=1S/C12H16O2/c1-11(6-5-9-13)14-10-12-7-3-2-4-8-12/h2-8,11,13H,9-10H2,1H3
InChI Key:
AJVCHDBBLSJHBP-UHFFFAOYSA-N
SMILES:
OC/C=C/[C@@H](OCc1ccccc1)C
Properties
Complexity:
160
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:
1
Isotope Atom Count:
0
Molecular Weight:
192.258g/mol
Monoisotopic Mass:
192.115g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
1.6
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