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4289-98-9 | For-Met-OH
CAS No: 4289-98-9 Catalog No: AG003T1J MDL No:MFCD00021033
Product Description
Catalog Number:
AG003T1J
Chemical Name:
For-Met-OH
CAS Number:
4289-98-9
Molecular Formula:
C6H11NO3S
Molecular Weight:
177.2214
MDL Number:
MFCD00021033
IUPAC Name:
(2S)-2-formamido-4-methylsulfanylbutanoic acid
InChI:
InChI=1S/C6H11NO3S/c1-11-3-2-5(6(9)10)7-4-8/h4-5H,2-3H2,1H3,(H,7,8)(H,9,10)/t5-/m0/s1
InChI Key:
PYUSHNKNPOHWEZ-YFKPBYRVSA-N
SMILES:
CSCC[C@@H](C(=O)O)NC=O
UNII:
PS9357B4XH
Properties
Complexity:
140
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
177.046g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
177.218g/mol
Monoisotopic Mass:
177.046g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
91.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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