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124335-65-5 | 1-Piperazineacetic acid, 4-(2-hydroxyethyl)-
CAS No: 124335-65-5 Catalog No: AG000LV8 MDL No:MFCD03444540
Product Description
Catalog Number:
AG000LV8
Chemical Name:
1-Piperazineacetic acid, 4-(2-hydroxyethyl)-
CAS Number:
124335-65-5
Molecular Formula:
C8H16N2O3
Molecular Weight:
188.2242
MDL Number:
MFCD03444540
IUPAC Name:
2-[4-(2-hydroxyethyl)piperazin-1-yl]acetic acid
InChI:
InChI=1S/C8H16N2O3/c11-6-5-9-1-3-10(4-2-9)7-8(12)13/h11H,1-7H2,(H,12,13)
InChI Key:
VCEKKKPFXABURR-UHFFFAOYSA-N
SMILES:
OCCN1CCN(CC1)CC(=O)O
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.116g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
188.227g/mol
Monoisotopic Mass:
188.116g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
64A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-3.3
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