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6007-26-7 | 2-METHYL-1,3-DITHIANE
CAS No: 6007-26-7 Catalog No: AG003HKZ MDL No:MFCD00014652
Product Description
Catalog Number:
AG003HKZ
Chemical Name:
2-METHYL-1,3-DITHIANE
CAS Number:
6007-26-7
Molecular Formula:
C5H10S2
Molecular Weight:
134.2629
MDL Number:
MFCD00014652
IUPAC Name:
2-methyl-1,3-dithiane
InChI:
InChI=1S/C5H10S2/c1-5-6-3-2-4-7-5/h5H,2-4H2,1H3
InChI Key:
KXROTPXCYDXGSC-UHFFFAOYSA-N
SMILES:
CC1SCCCS1
EC Number:
227-859-6
NSC Number:
249337
Properties
Complexity:
48
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
134.022g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
134.255g/mol
Monoisotopic Mass:
134.022g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
50.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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