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102153-48-0 | Naphthalene, 6-bromo-1-nitro-
CAS No: 102153-48-0 Catalog No: AG0006R0 MDL No:MFCD01464122
Product Description
Catalog Number:
AG0006R0
Chemical Name:
Naphthalene, 6-bromo-1-nitro-
CAS Number:
102153-48-0
Molecular Formula:
C10H6BrNO2
Molecular Weight:
252.0641
MDL Number:
MFCD01464122
IUPAC Name:
6-bromo-1-nitronaphthalene
InChI:
InChI=1S/C10H6BrNO2/c11-8-4-5-9-7(6-8)2-1-3-10(9)12(13)14/h1-6H
InChI Key:
PDWYRGAWLCDGMW-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)cccc2[N+](=O)[O-]
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.958g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
252.067g/mol
Monoisotopic Mass:
250.958g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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