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1820649-49-7 | 1-(4,5,6,7-Tetrahydro-1H-benzo[d]imidazol-2-yl)ethan-1-amine dihydrochloride
CAS No: 1820649-49-7 Catalog No: AG01FMJ0 MDL No:MFCD28370042
Product Description
Catalog Number:
AG01FMJ0
Chemical Name:
1-(4,5,6,7-Tetrahydro-1H-benzo[d]imidazol-2-yl)ethan-1-amine dihydrochloride
CAS Number:
1820649-49-7
Molecular Formula:
C9H17Cl2N3
Molecular Weight:
238.1574
MDL Number:
MFCD28370042
IUPAC Name:
1-(4,5,6,7-tetrahydro-1H-benzimidazol-2-yl)ethanamine;dihydrochloride
InChI:
InChI=1S/C9H15N3.2ClH/c1-6(10)9-11-7-4-2-3-5-8(7)12-9;;/h6H,2-5,10H2,1H3,(H,11,12);2*1H
InChI Key:
WTWZYKXOXJDXQE-UHFFFAOYSA-N
SMILES:
CC(c1nc2c([nH]1)CCCC2)N.Cl.Cl
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.08g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
238.156g/mol
Monoisotopic Mass:
237.08g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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