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Home > Other Building Blocks > 85514-85-8
85514-85-8 | (S)-Dodecane-1,2-diol
CAS No: 85514-85-8 Catalog No: AG003CIY MDL No:MFCD00798314
Product Description
Catalog Number:
AG003CIY
Chemical Name:
(S)-Dodecane-1,2-diol
CAS Number:
85514-85-8
Molecular Formula:
C12H26O2
Molecular Weight:
202.3336
MDL Number:
MFCD00798314
IUPAC Name:
(2S)-dodecane-1,2-diol
InChI:
InChI=1S/C12H26O2/c1-2-3-4-5-6-7-8-9-10-12(14)11-13/h12-14H,2-11H2,1H3/t12-/m0/s1
InChI Key:
ZITKDVFRMRXIJQ-LBPRGKRZSA-N
SMILES:
CCCCCCCCCC[C@@H](CO)O
Properties
Complexity:
105
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
202.193g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
202.338g/mol
Monoisotopic Mass:
202.193g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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