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Home > Bromides > 1305208-33-6
1305208-33-6 | 1H-Indazole, 6-broMo-4-(phenylMethoxy)-
CAS No: 1305208-33-6 Catalog No: AG000UK9 MDL No:
Product Description
Catalog Number:
AG000UK9
Chemical Name:
1H-Indazole, 6-broMo-4-(phenylMethoxy)-
CAS Number:
1305208-33-6
Molecular Formula:
C14H11BrN2O
Molecular Weight:
303.1539
IUPAC Name:
6-bromo-4-phenylmethoxy-1H-indazole
InChI:
InChI=1S/C14H11BrN2O/c15-11-6-13-12(8-16-17-13)14(7-11)18-9-10-4-2-1-3-5-10/h1-8H,9H2,(H,16,17)
InChI Key:
ZPKHTUZYNSFYLB-UHFFFAOYSA-N
SMILES:
Brc1cc(OCc2ccccc2)c2c(c1)[nH]nc2
Properties
Complexity:
271
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.005g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
303.159g/mol
Monoisotopic Mass:
302.005g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
37.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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