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88940-40-3 | 1H-Imidazole-1-butanamine, 2-methyl-
CAS No: 88940-40-3 Catalog No: AG0048E7 MDL No:MFCD06803454
Product Description
Catalog Number:
AG0048E7
Chemical Name:
1H-Imidazole-1-butanamine, 2-methyl-
CAS Number:
88940-40-3
Molecular Formula:
C8H15N3
Molecular Weight:
153.2248
MDL Number:
MFCD06803454
IUPAC Name:
4-(2-methylimidazol-1-yl)butan-1-amine
InChI:
InChI=1S/C8H15N3/c1-8-10-5-7-11(8)6-3-2-4-9/h5,7H,2-4,6,9H2,1H3
InChI Key:
HOIAWOKJIFZUMY-UHFFFAOYSA-N
SMILES:
NCCCCn1ccnc1C
Properties
Complexity:
106
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
153.127g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
153.229g/mol
Monoisotopic Mass:
153.127g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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