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1159823-99-0 | 1H-Indol-3-amine, 1-(phenylmethyl)-, hydrochloride (1:1)
CAS No: 1159823-99-0 Catalog No: AG000HC5 MDL No:MFCD12068394
Product Description
Catalog Number:
AG000HC5
Chemical Name:
1H-Indol-3-amine, 1-(phenylmethyl)-, hydrochloride (1:1)
CAS Number:
1159823-99-0
Molecular Formula:
C15H15ClN2
Molecular Weight:
258.7460
MDL Number:
MFCD12068394
IUPAC Name:
1-benzylindol-3-amine;hydrochloride
InChI:
InChI=1S/C15H14N2.ClH/c16-14-11-17(10-12-6-2-1-3-7-12)15-9-5-4-8-13(14)15;/h1-9,11H,10,16H2;1H
InChI Key:
CLQJYZRPQSBHCN-UHFFFAOYSA-N
SMILES:
Nc1cn(c2c1cccc2)Cc1ccccc1.Cl
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.092g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
258.749g/mol
Monoisotopic Mass:
258.092g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
31A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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