1,2,3,4-Butanetetrol, (2R,3S)-rel-


Chemical Name: 1,2,3,4-Butanetetrol, (2R,3S)-rel-
CAS Number: 149-32-6
Product Number: AG001LC9(AGN-PC-0Q34TN)
Synonyms:
MDL No:
Molecular Formula: C4H10O4
Molecular Weight: 122.1198

Identification/Properties


Computed Properties
Molecular Weight:
122.12g/mol
XLogP3:
-2.3
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
122.058g/mol
Monoisotopic Mass:
122.058g/mol
Topological Polar Surface Area:
80.9A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
48
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
2
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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