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131614-91-0 | 2-Oxiranemethanol, 3-(2-methylpropyl)-, (2S,3S)-
CAS No: 131614-91-0 Catalog No: AG000ZHY MDL No:
Product Description
Catalog Number:
AG000ZHY
Chemical Name:
2-Oxiranemethanol, 3-(2-methylpropyl)-, (2S,3S)-
CAS Number:
131614-91-0
Molecular Formula:
C7H14O2
Molecular Weight:
130.1849
IUPAC Name:
[(2S,3S)-3-(2-methylpropyl)oxiran-2-yl]methanol
InChI:
InChI=1S/C7H14O2/c1-5(2)3-6-7(4-8)9-6/h5-8H,3-4H2,1-2H3/t6-,7-/m0/s1
InChI Key:
TWUZZZWSLBSFGG-BQBZGAKWSA-N
SMILES:
OC[C@@H]1O[C@H]1CC(C)C
Properties
Complexity:
90.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
130.099g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
130.187g/mol
Monoisotopic Mass:
130.099g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
32.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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