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Home > Other Heterocycles > 1955548-40-9
1955548-40-9 | 2lambda4-thia-5-azabicyclo[2.2.1]heptan-2-one hydrochloride
CAS No: 1955548-40-9 Catalog No: AG01B1UH MDL No:MFCD29763468
Product Description
Catalog Number:
AG01B1UH
Chemical Name:
2lambda4-thia-5-azabicyclo[2.2.1]heptan-2-one hydrochloride
CAS Number:
1955548-40-9
Molecular Formula:
C5H10ClNOS
Molecular Weight:
167.6570
MDL Number:
MFCD29763468
IUPAC Name:
2λ4-thia-5-azabicyclo[2.2.1]heptane 2-oxide;hydrochloride
InChI:
InChI=1S/C5H9NOS.ClH/c7-8-3-4-1-5(8)2-6-4;/h4-6H,1-3H2;1H
InChI Key:
JBCMWVOOFXBLKR-UHFFFAOYSA-N
SMILES:
O=S1CC2CC1CN2.Cl
Properties
Complexity:
136
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.017g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
167.651g/mol
Monoisotopic Mass:
167.017g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
48.3A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
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