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71484-94-1 | 1,2-Propanediol, 3-methoxy-, (S)-
CAS No: 71484-94-1 Catalog No: AG005HPU MDL No:
Product Description
Catalog Number:
AG005HPU
Chemical Name:
1,2-Propanediol, 3-methoxy-, (S)-
CAS Number:
71484-94-1
Molecular Formula:
C4H10O3
Molecular Weight:
106.1204
IUPAC Name:
(2S)-3-methoxypropane-1,2-diol
InChI:
InChI=1S/C4H10O3/c1-7-3-4(6)2-5/h4-6H,2-3H2,1H3/t4-/m0/s1
InChI Key:
PSJBSUHYCGQTHZ-BYPYZUCNSA-N
SMILES:
COC[C@H](CO)O
Properties
Complexity:
37.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
106.063g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
106.121g/mol
Monoisotopic Mass:
106.063g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.2
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