Home Amines 7570-49-2
7570-49-2,MFCD02093426
Catalog No.:AA003MAQ
7570-49-2 | 5-Amino-2-methylindole
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  • Technical Information
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Technical Information
Catalog Number:
AA003MAQ
Chemical Name:
5-Amino-2-methylindole
CAS Number:
7570-49-2
Molecular Formula:
C9H10N2
Molecular Weight:
146.1891
MDL Number:
MFCD02093426
IUPAC Name:
2-methyl-1H-indol-5-amine
InChI:
InChI=1S/C9H10N2/c1-6-4-7-5-8(10)2-3-9(7)11-6/h2-5,11H,10H2,1H3
InChI Key:
JQULCCZIXYRBSE-UHFFFAOYSA-N
SMILES:
Nc1ccc2c(c1)cc([nH]2)C
Properties
Computed Properties
 
Complexity:
147  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
146.084g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
146.193g/mol
Monoisotopic Mass:
146.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  

Synonyms
 
5-Amino-2-methylindole 
2-methyl-1H-indol-5-amine 
AC1MC04H 
AC1Q2OC3 
BIDD:GT0193 
SCHEMBL397246 
2-methyl-1H-indol-5-ylamine 
1H-Indol-5-amine,2-methyl- 
AC1Q2O87 
2-methyl-1H-indol-5-yl amine 
5-Amino-2-methylindole, 97% 
1H-Indol-5-amine, 2-methyl- 
7570-49-2 
CTK5E1896 
DTXSID40370072 
JQULCCZIXYRBSE-UHFFFAOYSA-N 
ZINC152331 
ANW-36660 
BDBM50037813 
CA-669 
SBB028277 
AKOS002676314 
MCULE-9424804982 
2-methyl-5-aminoindole 
NE25704 
PS-5524 
RP01492 
SB14900 
SDCCGMLS-0065827.P001 
VI30250 
KS-0000172U 
NCGC00336680-01 
AJ-12726 
SC-65137 
CHEMBL3358228 
ZB005163 
DB-055983 
TR-024318 
FT-0612903 
FT-0619985 
ST50824030 
Y4012 
EN300-35694 
AB01330263-02 
570A492 
MFCD02093426 
A838492 
I10-0204 
J-509907 
Z367452324 
2-methyl-5-amino-1H-indole 
C9H10N2 
ZINC00152331 
CID2733992 
A1539 
2-methylindole-5-ylamine 
PubChem7273 
ACMC-209ozq 
2-methylindole-5-amine 
Literature

Title: Prediction of genotoxicity of chemical compounds by statistical learning methods.

Journal: Chemical research in toxicology 20050601

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