200,000+ products from a single source!
sales@angenechem.com
Home > Bromides > 1158503-82-2
1158503-82-2 | 1H-Indole-2-carboxylic acid, 7-bromo-, methyl ester
CAS No: 1158503-82-2 Catalog No: AG000GYH MDL No:MFCD11111832
Product Description
Catalog Number:
AG000GYH
Chemical Name:
1H-Indole-2-carboxylic acid, 7-bromo-, methyl ester
CAS Number:
1158503-82-2
Molecular Formula:
C10H8BrNO2
Molecular Weight:
254.0800
MDL Number:
MFCD11111832
IUPAC Name:
methyl 7-bromo-1H-indole-2-carboxylate
InChI:
InChI=1S/C10H8BrNO2/c1-14-10(13)8-5-6-3-2-4-7(11)9(6)12-8/h2-5,12H,1H3
InChI Key:
CVBRWYSFWORSON-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc2c([nH]1)c(Br)ccc2
Properties
Complexity:
234
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:
1
Isotope Atom Count:
0
Molecular Weight:
254.083g/mol
Monoisotopic Mass:
252.974g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
42.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.