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138300-59-1 | 1,3,4-Thiadiazole, 2-(chloromethyl)-5-cyclopropyl-
CAS No: 138300-59-1 Catalog No: AG0018GV MDL No:MFCD03789553
Product Description
Catalog Number:
AG0018GV
Chemical Name:
1,3,4-Thiadiazole, 2-(chloromethyl)-5-cyclopropyl-
CAS Number:
138300-59-1
Molecular Formula:
C6H7ClN2S
Molecular Weight:
174.6512
MDL Number:
MFCD03789553
IUPAC Name:
2-(chloromethyl)-5-cyclopropyl-1,3,4-thiadiazole
InChI:
InChI=1S/C6H7ClN2S/c7-3-5-8-9-6(10-5)4-1-2-4/h4H,1-3H2
InChI Key:
VDUGMUQOYNINHU-UHFFFAOYSA-N
SMILES:
ClCc1nnc(s1)C1CC1
Properties
Complexity:
129
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.002g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
174.646g/mol
Monoisotopic Mass:
174.002g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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