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88180-97-6 | 1H-Cycloprop[b]anthracene, 1a-bromo-9a-chloro-1a,2,9,9a-tetrahydro-
CAS No: 88180-97-6 Catalog No: AG004EVG MDL No:
Product Description
Catalog Number:
AG004EVG
Chemical Name:
1H-Cycloprop[b]anthracene, 1a-bromo-9a-chloro-1a,2,9,9a-tetrahydro-
CAS Number:
88180-97-6
Molecular Formula:
C15H12BrCl
Molecular Weight:
307.6128
IUPAC Name:
12-bromo-14-chlorotetracyclo[8.5.0.03,8.012,14]pentadeca-1,3,5,7,9-pentaene
InChI:
InChI=1S/C15H12BrCl/c16-14-7-12-5-10-3-1-2-4-11(10)6-13(12)8-15(14,17)9-14/h1-6H,7-9H2
InChI Key:
GJXBZVOBJWZMDI-UHFFFAOYSA-N
SMILES:
ClC12Cc3cc4ccccc4cc3CC2(C1)Br
Properties
Complexity:
344
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.981g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
307.615g/mol
Monoisotopic Mass:
305.981g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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