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Home > Bromides > 2137804-02-3
2137804-02-3 | 5-bromo-2,3-dihydro-1H-indole-6-carboxylic acid hydrochloride
CAS No: 2137804-02-3 Catalog No: AG01ELKA MDL No:MFCD31457157
Product Description
Catalog Number:
AG01ELKA
Chemical Name:
5-bromo-2,3-dihydro-1H-indole-6-carboxylic acid hydrochloride
CAS Number:
2137804-02-3
Molecular Formula:
C9H9BrClNO2
Molecular Weight:
278.5303
MDL Number:
MFCD31457157
IUPAC Name:
5-bromo-2,3-dihydro-1H-indole-6-carboxylic acid;hydrochloride
InChI:
InChI=1S/C9H8BrNO2.ClH/c10-7-3-5-1-2-11-8(5)4-6(7)9(12)13;/h3-4,11H,1-2H2,(H,12,13);1H
InChI Key:
SILSWSWPNFFVOC-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc2NCCc2cc1Br.Cl
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.951g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
278.53g/mol
Monoisotopic Mass:
276.951g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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