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16022-57-4

16022-57-4 | 1-Piperidinecarbodithioic acid, ethyl ester

CAS No: 16022-57-4 Catalog No: AG001RS2 MDL No:

Product Description

Catalog Number:
AG001RS2
Chemical Name:
1-Piperidinecarbodithioic acid, ethyl ester
CAS Number:
16022-57-4
Molecular Formula:
C8H15NS2
Molecular Weight:
189.3414
IUPAC Name:
ethyl piperidine-1-carbodithioate
InChI:
InChI=1S/C8H15NS2/c1-2-11-8(10)9-6-4-3-5-7-9/h2-7H2,1H3
InChI Key:
GODAWSWFAMASSD-UHFFFAOYSA-N
SMILES:
CCSC(=S)N1CCCCC1

Properties

Complexity:
130  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.065g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.335g/mol
Monoisotopic Mass:
189.065g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
60.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  

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