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22985-29-1 | Benzene, (2-bromo-2-chlorocyclopropyl)-
CAS No: 22985-29-1 Catalog No: AG002LSD MDL No:
Product Description
Catalog Number:
AG002LSD
Chemical Name:
Benzene, (2-bromo-2-chlorocyclopropyl)-
CAS Number:
22985-29-1
Molecular Formula:
C9H8BrCl
Molecular Weight:
231.5168
IUPAC Name:
(2-bromo-2-chlorocyclopropyl)benzene
InChI:
InChI=1S/C9H8BrCl/c10-9(11)6-8(9)7-4-2-1-3-5-7/h1-5,8H,6H2
InChI Key:
PGTIHSHVZGIQIK-UHFFFAOYSA-N
SMILES:
ClC1(Br)CC1c1ccccc1
Properties
Complexity:
154
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.95g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
231.517g/mol
Monoisotopic Mass:
229.95g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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