Home Amines 101831-71-4
101831-71-4,MFCD01719136
Catalog No.:AA0005LM
101831-71-4 | 3-(2-Aminoethyl)-1h-indole-5-carbonitrile hydrochloride
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Technical Information
Catalog Number:
AA0005LM
Chemical Name:
3-(2-Aminoethyl)-1h-indole-5-carbonitrile hydrochloride
CAS Number:
101831-71-4
Molecular Formula:
C11H12ClN3
Molecular Weight:
221.6861
MDL Number:
MFCD01719136
IUPAC Name:
3-(2-aminoethyl)-1H-indole-5-carbonitrile;hydrochloride
InChI:
InChI=1S/C11H11N3.ClH/c12-4-3-9-7-14-11-2-1-8(6-13)5-10(9)11;/h1-2,5,7,14H,3-4,12H2;1H
InChI Key:
VKJFRESIRBDHEZ-UHFFFAOYSA-N
SMILES:
NCCc1c[nH]c2c1cc(C#N)cc2.Cl
Properties
Computed Properties
 
Complexity:
242  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.072g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
221.688g/mol
Monoisotopic Mass:
221.072g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
65.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Synonyms
 
101831-71-4 
3-(2-aminoethyl)-1H-indole-5-carbonitrile hydrochloride 
DTXSID40144215 
VKJFRESIRBDHEZ-UHFFFAOYSA-N 
KS-00000F4X 
0483AA 
MFCD01719136 
DS-4565 
AK116348 
AM807528 
DA-16322 
LS-82431 
5-Cyanotryptamine hydrochloride 
AX8103770 
FT-0757624 
3-(2-aminoethyl)-5-cyano-1H-indole hydrochloride 
3-(2-aminoethyl)-1H-indole-5-carbonitrile;hydrochloride 
3-(2-Amino-ethyl)-1H-indole-5-carbonitrile; hydrochloride 
3-(2-aminoethyl)-1h-indole-5-carbonitrile hydrochloride(1:1) 
1H-Indole-5-carbonitrile, 3-(2-aminoethyl)-, hydrochloride (1:1) 
C11H12ClN3 
C11-H11-N3.Cl-H 
CID58925 
INDOLE-5-CARBONITRILE, 3-(2-AMINOETHYL)-, HYDROCHLORIDE 
3-(2-Aminoethyl)-1H-indole-5-carbonitrilehydrochloride 
3-(2-Aminoethyl)indole-5-carbonitrile hydrochloride 
3-(2-Amino-ethyl)-1H-indole-5-carbonitrile hydrochloride 
C-8975 
AC1Q3CEN 
AC1L1Q2G 
SCHEMBL7494814 
Literature
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