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101906-15-4 | 5-Hexen-3-ol, 5-methyl-1-(phenylmethoxy)-, (3R)-
CAS No: 101906-15-4 Catalog No: AG0005WL MDL No:
Product Description
Catalog Number:
AG0005WL
Chemical Name:
5-Hexen-3-ol, 5-methyl-1-(phenylmethoxy)-, (3R)-
CAS Number:
101906-15-4
Molecular Formula:
C14H20O2
Molecular Weight:
220.3074
IUPAC Name:
5-methyl-1-phenylmethoxyhex-5-en-3-ol
InChI:
InChI=1S/C14H20O2/c1-12(2)10-14(15)8-9-16-11-13-6-4-3-5-7-13/h3-7,14-15H,1,8-11H2,2H3
InChI Key:
RUUMBKJIKCUTPW-UHFFFAOYSA-N
SMILES:
CC(=C)C[C@H](CCOCc1ccccc1)O
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.146g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
220.312g/mol
Monoisotopic Mass:
220.146g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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