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Home > Bromides > 1260383-60-5
1260383-60-5 | 1H-Indole-3-carboxylic acid, 6-bromo-2-methyl-
CAS No: 1260383-60-5 Catalog No: AG000QSM MDL No:MFCD18380863
Product Description
Catalog Number:
AG000QSM
Chemical Name:
1H-Indole-3-carboxylic acid, 6-bromo-2-methyl-
CAS Number:
1260383-60-5
Molecular Formula:
C10H8BrNO2
Molecular Weight:
254.0800
MDL Number:
MFCD18380863
IUPAC Name:
6-bromo-2-methyl-1H-indole-3-carboxylic acid
InChI:
InChI=1S/C10H8BrNO2/c1-5-9(10(13)14)7-3-2-6(11)4-8(7)12-5/h2-4,12H,1H3,(H,13,14)
InChI Key:
LIWQAXXJLJKBKP-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)[nH]c(c2C(=O)O)C
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.974g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
254.083g/mol
Monoisotopic Mass:
252.974g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
53.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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