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Home > Other Heterocycles > 75332-36-4
75332-36-4 | Bicyclo[2.2.1]heptan-2-ol, 3,3-dimethoxy-
CAS No: 75332-36-4 Catalog No: AG005C7E MDL No:
Product Description
Catalog Number:
AG005C7E
Chemical Name:
Bicyclo[2.2.1]heptan-2-ol, 3,3-dimethoxy-
CAS Number:
75332-36-4
Molecular Formula:
C9H16O3
Molecular Weight:
172.2215
IUPAC Name:
3,3-dimethoxybicyclo[2.2.1]heptan-2-ol
InChI:
InChI=1S/C9H16O3/c1-11-9(12-2)7-4-3-6(5-7)8(9)10/h6-8,10H,3-5H2,1-2H3
InChI Key:
OZXHQHMTASSNBO-UHFFFAOYSA-N
SMILES:
COC1(OC)C2CCC(C1O)C2
Properties
Complexity:
177
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.11g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
172.224g/mol
Monoisotopic Mass:
172.11g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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