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Home > Other Heterocycles > 21301-95-1
21301-95-1 | Bicyclo[2.2.1]heptan-2-ol, nitrate
CAS No: 21301-95-1 Catalog No: AG0072Z3 MDL No:
Product Description
Catalog Number:
AG0072Z3
Chemical Name:
Bicyclo[2.2.1]heptan-2-ol, nitrate
CAS Number:
21301-95-1
Molecular Formula:
C7H13NO4
Molecular Weight:
175.1824
IUPAC Name:
bicyclo[2.2.1]heptan-2-ol;nitric acid
InChI:
InChI=1S/C7H12O.HNO3/c8-7-4-5-1-2-6(7)3-5;2-1(3)4/h5-8H,1-4H2;(H,2,3,4)
InChI Key:
XLXUTOLDCSSEMH-UHFFFAOYSA-N
SMILES:
OC1CC2CC1CC2.[O-][N+](=O)O
Properties
Complexity:
125
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.084g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
175.184g/mol
Monoisotopic Mass:
175.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
86.3A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
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