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Home > Other Heterocycles > 116370-49-1
116370-49-1 | Spiro[bicyclo[2.2.1]heptane-2,1'-cyclohexan]-3-ol, 4,7,7-trimethyl-
CAS No: 116370-49-1 Catalog No: AG000CBQ MDL No:
Product Description
Catalog Number:
AG000CBQ
Chemical Name:
Spiro[bicyclo[2.2.1]heptane-2,1'-cyclohexan]-3-ol, 4,7,7-trimethyl-
CAS Number:
116370-49-1
Molecular Formula:
C15H26O
Molecular Weight:
222.3663
IUPAC Name:
1,7,7-trimethylspiro[bicyclo[2.2.1]heptane-3,1'-cyclohexane]-2-ol
InChI:
InChI=1S/C15H26O/c1-13(2)11-7-10-14(13,3)12(16)15(11)8-5-4-6-9-15/h11-12,16H,4-10H2,1-3H3
InChI Key:
HLUWTOMXCGTCQF-UHFFFAOYSA-N
SMILES:
OC1C2(CCCCC2)C2C(C1(C)CC2)(C)C
Properties
Complexity:
301
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.198g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
222.372g/mol
Monoisotopic Mass:
222.198g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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