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Home > Other Heterocycles > 20224-38-8
20224-38-8 | Bicyclo[2.2.1]hept-5-ene-2,3-diol, (1R,2R,3S,4S)-rel-
CAS No: 20224-38-8 Catalog No: AG00285Q MDL No:
Product Description
Catalog Number:
AG00285Q
Chemical Name:
Bicyclo[2.2.1]hept-5-ene-2,3-diol, (1R,2R,3S,4S)-rel-
CAS Number:
20224-38-8
Molecular Formula:
C7H10O2
Molecular Weight:
126.1531
IUPAC Name:
bicyclo[2.2.1]hept-5-ene-2,3-diol
InChI:
InChI=1S/C7H10O2/c8-6-4-1-2-5(3-4)7(6)9/h1-2,4-9H,3H2
InChI Key:
TZLWRLOYRRZECT-UHFFFAOYSA-N
SMILES:
O[C@@H]1[C@H]2C=C[C@@H]([C@@H]1O)C2
NSC Number:
107386
Properties
Complexity:
137
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126.068g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
126.155g/mol
Monoisotopic Mass:
126.068g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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