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158330-91-7 | 1H-Indene, 5-bromo-1-chloro-2,3-dihydro-
CAS No: 158330-91-7 Catalog No: AG001Q4S MDL No:MFCD09907893
Product Description
Catalog Number:
AG001Q4S
Chemical Name:
1H-Indene, 5-bromo-1-chloro-2,3-dihydro-
CAS Number:
158330-91-7
Molecular Formula:
C9H8BrCl
Molecular Weight:
231.5168
MDL Number:
MFCD09907893
IUPAC Name:
5-bromo-1-chloro-2,3-dihydro-1H-indene
InChI:
InChI=1S/C9H8BrCl/c10-7-2-3-8-6(5-7)1-4-9(8)11/h2-3,5,9H,1,4H2
InChI Key:
BPOKNBVVGMFTRB-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)CCC2Cl
Properties
Complexity:
149
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:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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