200,000+ products from a single source!
sales@angenechem.com
30933-69-8 | 1H-Indole-2-carboxylic acid, 4-bromo-5-methoxy-, ethyl ester
CAS No: 30933-69-8 Catalog No: AG0031P1 MDL No:MFCD09265488
Product Description
Catalog Number:
AG0031P1
Chemical Name:
1H-Indole-2-carboxylic acid, 4-bromo-5-methoxy-, ethyl ester
CAS Number:
30933-69-8
Molecular Formula:
C12H12BrNO3
Molecular Weight:
298.1326
MDL Number:
MFCD09265488
IUPAC Name:
ethyl 4-bromo-5-methoxy-1H-indole-2-carboxylate
InChI:
InChI=1S/C12H12BrNO3/c1-3-17-12(15)9-6-7-8(14-9)4-5-10(16-2)11(7)13/h4-6,14H,3H2,1-2H3
InChI Key:
NBTXRPQZVZUOGD-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cc2c([nH]1)ccc(c2Br)OC
Properties
Complexity:
287
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
298.136g/mol
Monoisotopic Mass:
297g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
51.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.