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Home > Other Heterocycles > 1515534-09-4
1515534-09-4 | {spiro[2.3]hexan-1-yl}methanol
CAS No: 1515534-09-4 Catalog No: AG01BHW1 MDL No:MFCD24089502
Product Description
Catalog Number:
AG01BHW1
Chemical Name:
{spiro[2.3]hexan-1-yl}methanol
CAS Number:
1515534-09-4
Molecular Formula:
C7H12O
Molecular Weight:
112.1696
MDL Number:
MFCD24089502
IUPAC Name:
spiro[2.3]hexan-2-ylmethanol
InChI:
InChI=1S/C7H12O/c8-5-6-4-7(6)2-1-3-7/h6,8H,1-5H2
InChI Key:
YYZPWAZTBRUHPX-UHFFFAOYSA-N
SMILES:
OCC1CC21CCC2
Properties
Complexity:
105
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
112.089g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
112.172g/mol
Monoisotopic Mass:
112.089g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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