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113741-02-9 | 1H-Imidazole-1-ethanamine, 2-ethyl-
CAS No: 113741-02-9 Catalog No: AG0009ID MDL No:MFCD14586480
Product Description
Catalog Number:
AG0009ID
Chemical Name:
1H-Imidazole-1-ethanamine, 2-ethyl-
CAS Number:
113741-02-9
Molecular Formula:
C7H13N3
Molecular Weight:
139.1982
MDL Number:
MFCD14586480
IUPAC Name:
2-(2-ethylimidazol-1-yl)ethanamine
InChI:
InChI=1S/C7H13N3/c1-2-7-9-4-6-10(7)5-3-8/h4,6H,2-3,5,8H2,1H3
InChI Key:
BOANVMYDGKUJAC-UHFFFAOYSA-N
SMILES:
NCCn1ccnc1CC
Properties
Complexity:
94.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
139.111g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
139.202g/mol
Monoisotopic Mass:
139.111g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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