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Home > Other Heterocycles > 16725-98-7
16725-98-7 | Bicyclo[4.1.0]heptan-3-ol, 4,7,7-trimethyl-
CAS No: 16725-98-7 Catalog No: AG001X7V MDL No:
Product Description
Catalog Number:
AG001X7V
Chemical Name:
Bicyclo[4.1.0]heptan-3-ol, 4,7,7-trimethyl-
CAS Number:
16725-98-7
Molecular Formula:
C10H18O
Molecular Weight:
154.2493
IUPAC Name:
4,7,7-trimethylbicyclo[4.1.0]heptan-3-ol
InChI:
InChI=1S/C10H18O/c1-6-4-7-8(5-9(6)11)10(7,2)3/h6-9,11H,4-5H2,1-3H3
InChI Key:
WHXOMZVLSNHION-UHFFFAOYSA-N
SMILES:
CC1CC2C(CC1O)C2(C)C
NSC Number:
146237
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.136g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
154.253g/mol
Monoisotopic Mass:
154.136g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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