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264276-18-8 | 1H-Indazole, 4-(bromomethyl)-, hydrobromide (1:1)
CAS No: 264276-18-8 Catalog No: AG002T6N MDL No:
Product Description
Catalog Number:
AG002T6N
Chemical Name:
1H-Indazole, 4-(bromomethyl)-, hydrobromide (1:1)
CAS Number:
264276-18-8
Molecular Formula:
C8H8Br2N2
Molecular Weight:
291.9705
IUPAC Name:
4-(bromomethyl)-1H-indazole;hydrobromide
InChI:
InChI=1S/C8H7BrN2.BrH/c9-4-6-2-1-3-8-7(6)5-10-11-8;/h1-3,5H,4H2,(H,10,11);1H
InChI Key:
NXPNEYAWBKBBMP-UHFFFAOYSA-N
SMILES:
BrCc1cccc2c1cn[nH]2.Br
Properties
Complexity:
140
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.903g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
291.974g/mol
Monoisotopic Mass:
289.905g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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