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1798-13-6 | Glycine, N,N'-1,4-butanediylbis[N-(carboxymethyl)-
CAS No: 1798-13-6 Catalog No: AG0027A5 MDL No:
Product Description
Catalog Number:
AG0027A5
Chemical Name:
Glycine, N,N'-1,4-butanediylbis[N-(carboxymethyl)-
CAS Number:
1798-13-6
Molecular Formula:
C12H20N2O8
Molecular Weight:
320.2958
IUPAC Name:
2-[4-[bis(carboxymethyl)amino]butyl-(carboxymethyl)amino]acetic acid
InChI:
InChI=1S/C12H20N2O8/c15-9(16)5-13(6-10(17)18)3-1-2-4-14(7-11(19)20)8-12(21)22/h1-8H2,(H,15,16)(H,17,18)(H,19,20)(H,21,22)
InChI Key:
ZIMXAFGAUMQPMG-UHFFFAOYSA-N
SMILES:
OC(=O)CN(CC(=O)O)CCCCN(CC(=O)O)CC(=O)O
NSC Number:
18486
Properties
Complexity:
342
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
320.122g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
10
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
320.298g/mol
Monoisotopic Mass:
320.122g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
156A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-5.2
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