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Home > Aldehydes > 133093-79-5
133093-79-5 | 1-Piperazinecarboxaldehyde, 4-(2-aminoethyl)-
CAS No: 133093-79-5 Catalog No: AG00148E MDL No:
Product Description
Catalog Number:
AG00148E
Chemical Name:
1-Piperazinecarboxaldehyde, 4-(2-aminoethyl)-
CAS Number:
133093-79-5
Molecular Formula:
C7H15N3O
Molecular Weight:
157.2135
IUPAC Name:
4-(2-aminoethyl)piperazine-1-carbaldehyde
InChI:
InChI=1S/C7H15N3O/c8-1-2-9-3-5-10(7-11)6-4-9/h7H,1-6,8H2
InChI Key:
JLEHUCNAWHLRON-UHFFFAOYSA-N
SMILES:
NCCN1CCN(CC1)C=O
Properties
Complexity:
121
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.122g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
157.217g/mol
Monoisotopic Mass:
157.122g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.4
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