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136416-21-2 | Benzenepropanol, 2-phenoxy-
CAS No: 136416-21-2 Catalog No: AG0011V2 MDL No:
Product Description
Catalog Number:
AG0011V2
Chemical Name:
Benzenepropanol, 2-phenoxy-
CAS Number:
136416-21-2
Molecular Formula:
C15H16O2
Molecular Weight:
228.2863
IUPAC Name:
3-(2-phenoxyphenyl)propan-1-ol
InChI:
InChI=1S/C15H16O2/c16-12-6-8-13-7-4-5-11-15(13)17-14-9-2-1-3-10-14/h1-5,7,9-11,16H,6,8,12H2
InChI Key:
YSHVHPBUFKUXKA-UHFFFAOYSA-N
SMILES:
OCCCc1ccccc1Oc1ccccc1
Properties
Complexity:
199
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.115g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
228.291g/mol
Monoisotopic Mass:
228.115g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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