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16326-27-5 | 6-Oxabicyclo[3.1.0]hexan-2-ol, 3-bromo-, DL- (8CI)
CAS No: 16326-27-5 Catalog No: AG001TYD MDL No:
Product Description
Catalog Number:
AG001TYD
Chemical Name:
6-Oxabicyclo[3.1.0]hexan-2-ol, 3-bromo-, DL- (8CI)
CAS Number:
16326-27-5
Molecular Formula:
C5H7BrO2
Molecular Weight:
179.0119
IUPAC Name:
3-bromo-6-oxabicyclo[3.1.0]hexan-2-ol
InChI:
InChI=1S/C5H7BrO2/c6-2-1-3-5(8-3)4(2)7/h2-5,7H,1H2
InChI Key:
OKBCMWAEJIZITM-UHFFFAOYSA-N
SMILES:
BrC1CC2C(C1O)O2
NSC Number:
128290
Properties
Complexity:
117
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.963g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
179.013g/mol
Monoisotopic Mass:
177.963g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.8A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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