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89376-43-2 | 3-Penten-2-one, 4-[(2-aminoethyl)amino]-
CAS No: 89376-43-2 Catalog No: AG003WC5 MDL No:
Product Description
Catalog Number:
AG003WC5
Chemical Name:
3-Penten-2-one, 4-[(2-aminoethyl)amino]-
CAS Number:
89376-43-2
Molecular Formula:
C7H14N2O
Molecular Weight:
142.1989
IUPAC Name:
4-(2-aminoethylamino)pent-3-en-2-one
InChI:
InChI=1S/C7H14N2O/c1-6(5-7(2)10)9-4-3-8/h5,9H,3-4,8H2,1-2H3
InChI Key:
OCVAOVYELZVEGF-UHFFFAOYSA-N
SMILES:
CC(=CC(=O)C)NCCN
Properties
Complexity:
141
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.111g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
142.202g/mol
Monoisotopic Mass:
142.111g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
0.2
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