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10060-88-5 | 3-Thiazolidineethanol, 2-imino-α-phenyl-
CAS No: 10060-88-5 Catalog No: AG0002GN MDL No:
Product Description
Catalog Number:
AG0002GN
Chemical Name:
3-Thiazolidineethanol, 2-imino-α-phenyl-
CAS Number:
10060-88-5
Molecular Formula:
C11H14N2OS
Molecular Weight:
222.3067
IUPAC Name:
2-(2-imino-1,3-thiazolidin-3-yl)-1-phenylethanol
InChI:
InChI=1S/C11H14N2OS/c12-11-13(6-7-15-11)8-10(14)9-4-2-1-3-5-9/h1-5,10,12,14H,6-8H2
InChI Key:
UTHQDRBQLOYOFO-UHFFFAOYSA-N
SMILES:
OC(c1ccccc1)CN1CCSC1=N
EC Number:
233-194-2
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.083g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
222.306g/mol
Monoisotopic Mass:
222.083g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
72.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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