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1732-25-8 | Pyrene, 4-bromo-1,2,3,6,7,8-hexahydro-
CAS No: 1732-25-8 Catalog No: AG001YPF MDL No:MFCD01571021
Product Description
Catalog Number:
AG001YPF
Chemical Name:
Pyrene, 4-bromo-1,2,3,6,7,8-hexahydro-
CAS Number:
1732-25-8
Molecular Formula:
C16H15Br
Molecular Weight:
287.1943
MDL Number:
MFCD01571021
IUPAC Name:
4-bromo-1,2,3,6,7,8-hexahydropyrene
InChI:
InChI=1S/C16H15Br/c17-14-9-12-5-1-3-10-7-8-11-4-2-6-13(14)16(11)15(10)12/h7-9H,1-6H2
InChI Key:
SIJTUAANVIVBQW-UHFFFAOYSA-N
SMILES:
Brc1cc2CCCc3c2c2c1CCCc2cc3
Properties
Complexity:
300
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.036g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
287.2g/mol
Monoisotopic Mass:
286.036g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5
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