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7433-23-0 | Sebacic acid, compound with piperazine (1:1)
CAS No: 7433-23-0 Catalog No: AG005CFG MDL No:
Product Description
Catalog Number:
AG005CFG
Chemical Name:
Sebacic acid, compound with piperazine (1:1)
CAS Number:
7433-23-0
Molecular Formula:
C14H28N2O4
Molecular Weight:
288.3831
IUPAC Name:
decanedioic acid;piperazine
InChI:
InChI=1S/C10H18O4.C4H10N2/c11-9(12)7-5-3-1-2-4-6-8-10(13)14;1-2-6-4-3-5-1/h1-8H2,(H,11,12)(H,13,14);5-6H,1-4H2
InChI Key:
AABVNLKNIVLBCB-UHFFFAOYSA-N
SMILES:
N1CCNCC1.OC(=O)CCCCCCCCC(=O)O
EC Number:
231-079-1
UNII:
X1EUC610UJ
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.205g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
288.388g/mol
Monoisotopic Mass:
288.205g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
98.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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