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121885-12-9 | 2-Piperazinemethanamine, N-(1,1-dimethylethyl)-
CAS No: 121885-12-9 Catalog No: AG0016CI MDL No:
Product Description
Catalog Number:
AG0016CI
Chemical Name:
2-Piperazinemethanamine, N-(1,1-dimethylethyl)-
CAS Number:
121885-12-9
Molecular Formula:
C9H21N3
Molecular Weight:
171.2831
IUPAC Name:
2-methyl-N-(piperazin-2-ylmethyl)propan-2-amine
InChI:
InChI=1S/C9H21N3/c1-9(2,3)12-7-8-6-10-4-5-11-8/h8,10-12H,4-7H2,1-3H3
InChI Key:
TUKAUAUHPNMDKL-UHFFFAOYSA-N
SMILES:
CC(NCC1NCCNC1)(C)C
Properties
Complexity:
128
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.174g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
171.288g/mol
Monoisotopic Mass:
171.174g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
36.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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