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Home > Other Heterocycles > 98205-39-1
98205-39-1 | Bicyclo[2.2.1]heptan-2-ol, 1,3-dimethyl-3-(4-methyl-3-pentenyl)-
CAS No: 98205-39-1 Catalog No: AG005VO2 MDL No:
Product Description
Catalog Number:
AG005VO2
Chemical Name:
Bicyclo[2.2.1]heptan-2-ol, 1,3-dimethyl-3-(4-methyl-3-pentenyl)-
CAS Number:
98205-39-1
Molecular Formula:
C15H26O
Molecular Weight:
222.3663
IUPAC Name:
1,3-dimethyl-3-(4-methylpent-3-enyl)bicyclo[2.2.1]heptan-2-ol
InChI:
InChI=1S/C15H26O/c1-11(2)6-5-8-15(4)12-7-9-14(3,10-12)13(15)16/h6,12-13,16H,5,7-10H2,1-4H3
InChI Key:
HUPMOVXWRYIDJU-UHFFFAOYSA-N
SMILES:
CC(=CCCC1(C)C2CCC(C1O)(C2)C)C
Properties
Complexity:
303
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:
3
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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