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20047-65-8 | Bicyclo[2.2.1]hept-2-ene, 7-bromo-, (7-syn)-
CAS No: 20047-65-8 Catalog No: AG002CSV MDL No:MFCD01862962
Product Description
Catalog Number:
AG002CSV
Chemical Name:
Bicyclo[2.2.1]hept-2-ene, 7-bromo-, (7-syn)-
CAS Number:
20047-65-8
Molecular Formula:
C7H9Br
Molecular Weight:
173.0504
MDL Number:
MFCD01862962
IUPAC Name:
7-bromobicyclo[2.2.1]hept-2-ene
InChI:
InChI=1S/C7H9Br/c8-7-5-1-2-6(7)4-3-5/h1-2,5-7H,3-4H2
InChI Key:
XFPAUZYYSFLZRD-UHFFFAOYSA-N
SMILES:
BrC1C2CCC1C=C2
NSC Number:
110572
Properties
Complexity:
114
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.989g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
173.053g/mol
Monoisotopic Mass:
171.989g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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