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137197-06-9 | L-Threonine, N-acetyl-, acetate (ester) (9CI)
CAS No: 137197-06-9 Catalog No: AG0012WR MDL No:
Product Description
Catalog Number:
AG0012WR
Chemical Name:
L-Threonine, N-acetyl-, acetate (ester) (9CI)
CAS Number:
137197-06-9
IUPAC Name:
(2S,3R)-2-acetamido-3-acetyloxybutanoic acid
InChI:
InChI=1S/C8H13NO5/c1-4(14-6(3)11)7(8(12)13)9-5(2)10/h4,7H,1-3H3,(H,9,10)(H,12,13)/t4-,7+/m1/s1
InChI Key:
FHYSLJXFHVWFLV-FBCQKBJTSA-N
Properties
Complexity:
250
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
203.079g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
203.194g/mol
Monoisotopic Mass:
203.079g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
92.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
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