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113561-31-2 | L-Methionine, N-(3,4-dihydro-2H-pyrrol-5-yl)-
CAS No: 113561-31-2 Catalog No: AG0008ZO MDL No:
Product Description
Catalog Number:
AG0008ZO
Chemical Name:
L-Methionine, N-(3,4-dihydro-2H-pyrrol-5-yl)-
CAS Number:
113561-31-2
Molecular Formula:
C9H16N2O2S
Molecular Weight:
216.3005
IUPAC Name:
2-(3,4-dihydro-2H-pyrrol-5-ylamino)-4-methylsulfanylbutanoic acid
InChI:
InChI=1S/C9H16N2O2S/c1-14-6-4-7(9(12)13)11-8-3-2-5-10-8/h7H,2-6H2,1H3,(H,10,11)(H,12,13)
InChI Key:
HCXIOYRYDIDAEZ-UHFFFAOYSA-N
SMILES:
CSCC[C@@H](C(=O)O)NC1=NCCC1
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.093g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
216.299g/mol
Monoisotopic Mass:
216.093g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
87A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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