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17325-85-8 | (S)-3-(Benzyloxy)propane-1,2-diol
CAS No: 17325-85-8 Catalog No: AG003CDW MDL No:MFCD00077914
Product Description
Catalog Number:
AG003CDW
Chemical Name:
(S)-3-(Benzyloxy)propane-1,2-diol
CAS Number:
17325-85-8
Molecular Formula:
C10H14O3
Molecular Weight:
182.2164
MDL Number:
MFCD00077914
IUPAC Name:
(2S)-3-phenylmethoxypropane-1,2-diol
InChI:
InChI=1S/C10H14O3/c11-6-10(12)8-13-7-9-4-2-1-3-5-9/h1-5,10-12H,6-8H2/t10-/m0/s1
InChI Key:
LWCIBYRXSHRIAP-JTQLQIEISA-N
SMILES:
OC[C@@H](COCc1ccccc1)O
EC Number:
605-668-2
Properties
Complexity:
121
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
182.094g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
182.219g/mol
Monoisotopic Mass:
182.094g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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