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14631-30-2 | Glycine, N-[5-(1,2-dithiolan-3-yl)-1-oxopentyl]-
CAS No: 14631-30-2 Catalog No: AG001DWI MDL No:
Product Description
Catalog Number:
AG001DWI
Chemical Name:
Glycine, N-[5-(1,2-dithiolan-3-yl)-1-oxopentyl]-
CAS Number:
14631-30-2
Molecular Formula:
C10H17NO3S2
Molecular Weight:
263.3769
IUPAC Name:
2-[5-(dithiolan-3-yl)pentanoylamino]acetic acid
InChI:
InChI=1S/C10H17NO3S2/c12-9(11-7-10(13)14)4-2-1-3-8-5-6-15-16-8/h8H,1-7H2,(H,11,12)(H,13,14)
InChI Key:
OEMVHEWPHWIYFN-UHFFFAOYSA-N
SMILES:
O=C(NCC(=O)O)CCCCC1SSCC1
Properties
Complexity:
248
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.065g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
263.37g/mol
Monoisotopic Mass:
263.065g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
117A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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