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15563-45-8 | Methanethione, phenyl-1-pyrrolidinyl-
CAS No: 15563-45-8 Catalog No: AG001O2X MDL No:MFCD03196207
Product Description
Catalog Number:
AG001O2X
Chemical Name:
Methanethione, phenyl-1-pyrrolidinyl-
CAS Number:
15563-45-8
Molecular Formula:
C11H13NS
Molecular Weight:
191.2926
MDL Number:
MFCD03196207
IUPAC Name:
phenyl(pyrrolidin-1-yl)methanethione
InChI:
InChI=1S/C11H13NS/c13-11(12-8-4-5-9-12)10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9H2
InChI Key:
RTZUSCLEISSKNQ-UHFFFAOYSA-N
SMILES:
S=C(c1ccccc1)N1CCCC1
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.077g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
191.292g/mol
Monoisotopic Mass:
191.077g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
35.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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