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85373-58-6 | tetrahydro-2h-pyran-2,2-diyldimethanol
CAS No: 85373-58-6 Catalog No: AG004KU4 MDL No:
Product Description
Catalog Number:
AG004KU4
Chemical Name:
tetrahydro-2h-pyran-2,2-diyldimethanol
CAS Number:
85373-58-6
Molecular Formula:
C7H14O3
Molecular Weight:
146.1843
IUPAC Name:
[2-(hydroxymethyl)oxan-2-yl]methanol
InChI:
InChI=1S/C7H14O3/c8-5-7(6-9)3-1-2-4-10-7/h8-9H,1-6H2
InChI Key:
FZXBUTYKROASFB-UHFFFAOYSA-N
SMILES:
OCC1(CO)CCCCO1
NSC Number:
97514
Properties
Complexity:
99
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
146.094g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
146.186g/mol
Monoisotopic Mass:
146.094g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
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