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156941-60-5 | 1H-Indole-3-ethanamine, 7-bromo-, hydrochloride (1:1)
CAS No: 156941-60-5 Catalog No: AG001P4A MDL No:MFCD11109986
Product Description
Catalog Number:
AG001P4A
Chemical Name:
1H-Indole-3-ethanamine, 7-bromo-, hydrochloride (1:1)
CAS Number:
156941-60-5
Molecular Formula:
C10H12BrClN2
Molecular Weight:
275.5727
MDL Number:
MFCD11109986
IUPAC Name:
2-(7-bromo-1H-indol-3-yl)ethanamine;hydrochloride
InChI:
InChI=1S/C10H11BrN2.ClH/c11-9-3-1-2-8-7(4-5-12)6-13-10(8)9;/h1-3,6,13H,4-5,12H2;1H
InChI Key:
FNGKXNLFBJRRGO-UHFFFAOYSA-N
SMILES:
NCCc1c[nH]c2c1cccc2Br.Cl
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.987g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
275.574g/mol
Monoisotopic Mass:
273.987g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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