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Home > Other Heterocycles > 71162-31-7
71162-31-7 | bicyclo[2.2.1]heptane-2-thiol
CAS No: 71162-31-7 Catalog No: AG019YSY MDL No:MFCD23792366
Product Description
Catalog Number:
AG019YSY
Chemical Name:
bicyclo[2.2.1]heptane-2-thiol
CAS Number:
71162-31-7
Molecular Formula:
C7H12S
Molecular Weight:
128.2352
MDL Number:
MFCD23792366
IUPAC Name:
bicyclo[2.2.1]heptane-2-thiol
InChI:
InChI=1S/C7H12S/c8-7-4-5-1-2-6(7)3-5/h5-8H,1-4H2
InChI Key:
IOPZYMJYUACERA-UHFFFAOYSA-N
SMILES:
SC1CC2CC1CC2
Properties
Complexity:
101
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
128.066g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
128.233g/mol
Monoisotopic Mass:
128.066g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
1A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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