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76891-07-1 | DIAMINOETHANE TARTRATE
CAS No: 76891-07-1 Catalog No: AG005G4W MDL No:
Product Description
Catalog Number:
AG005G4W
Chemical Name:
DIAMINOETHANE TARTRATE
CAS Number:
76891-07-1
Molecular Formula:
C6H14N2O6
Molecular Weight:
210.1852
IUPAC Name:
2,3-dihydroxybutanedioic acid;ethane-1,1-diamine
InChI:
InChI=1S/C4H6O6.C2H8N2/c5-1(3(7)8)2(6)4(9)10;1-2(3)4/h1-2,5-6H,(H,7,8)(H,9,10);2H,3-4H2,1H3
InChI Key:
HJTCSNBENABYOQ-UHFFFAOYSA-N
SMILES:
OC(C(C(=O)O)O)C(=O)O.CC(N)N
Properties
Complexity:
145
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.085g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
6
Isotope Atom Count:
0
Molecular Weight:
210.186g/mol
Monoisotopic Mass:
210.085g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
167A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
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