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101398-19-0 | 3-Furanol, tetrahydro-2,2-dimethyl-
CAS No: 101398-19-0 Catalog No: AG0004E1 MDL No:
Product Description
Catalog Number:
AG0004E1
Chemical Name:
3-Furanol, tetrahydro-2,2-dimethyl-
CAS Number:
101398-19-0
Molecular Formula:
C6H12O2
Molecular Weight:
116.1583
IUPAC Name:
2,2-dimethyloxolan-3-ol
InChI:
InChI=1S/C6H12O2/c1-6(2)5(7)3-4-8-6/h5,7H,3-4H2,1-2H3
InChI Key:
PBVVKKCMOMDGNB-UHFFFAOYSA-N
SMILES:
OC1CCOC1(C)C
Properties
Complexity:
88.5
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
116.084g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
116.16g/mol
Monoisotopic Mass:
116.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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