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1384264-16-7 | 1H-Indole-2-carboxylic acid, 6-amino-2,3-dihydro-, methyl ester, hydrochloride (1:2)
CAS No: 1384264-16-7 Catalog No: AG00194N MDL No:
Product Description
Catalog Number:
AG00194N
Chemical Name:
1H-Indole-2-carboxylic acid, 6-amino-2,3-dihydro-, methyl ester, hydrochloride (1:2)
CAS Number:
1384264-16-7
Molecular Formula:
C10H14Cl2N2O2
Molecular Weight:
265.1364
IUPAC Name:
methyl 6-amino-2,3-dihydro-1H-indole-2-carboxylate;dihydrochloride
InChI:
InChI=1S/C10H12N2O2.2ClH/c1-14-10(13)9-4-6-2-3-7(11)5-8(6)12-9;;/h2-3,5,9,12H,4,11H2,1H3;2*1H
InChI Key:
QHYLAOCMLPIXRH-UHFFFAOYSA-N
SMILES:
COC(=O)C1Cc2c(N1)cc(cc2)N.Cl.Cl
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.043g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
265.134g/mol
Monoisotopic Mass:
264.043g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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