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1257081-01-8 | 3-Piperidinethiol, hydrochloride (1:1)
CAS No: 1257081-01-8 Catalog No: AG000OIN MDL No:MFCD16039582
Product Description
Catalog Number:
AG000OIN
Chemical Name:
3-Piperidinethiol, hydrochloride (1:1)
CAS Number:
1257081-01-8
Molecular Formula:
C5H12ClNS
Molecular Weight:
153.6735
MDL Number:
MFCD16039582
IUPAC Name:
piperidine-3-thiol;hydrochloride
InChI:
InChI=1S/C5H11NS.ClH/c7-5-2-1-3-6-4-5;/h5-7H,1-4H2;1H
InChI Key:
PTPVVEVNGARLMO-UHFFFAOYSA-N
SMILES:
SC1CCCNC1.Cl
Properties
Complexity:
56
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
153.038g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
153.668g/mol
Monoisotopic Mass:
153.038g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
13A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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