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89187-92-8 | 2(1H)-Pyrimidinethione, 4,4,6-triethyl-3,4-dihydro-
CAS No: 89187-92-8 Catalog No: AG003VNC MDL No:
Product Description
Catalog Number:
AG003VNC
Chemical Name:
2(1H)-Pyrimidinethione, 4,4,6-triethyl-3,4-dihydro-
CAS Number:
89187-92-8
Molecular Formula:
C10H18N2S
Molecular Weight:
198.3283
IUPAC Name:
4,4,6-triethyl-1,3-dihydropyrimidine-2-thione
InChI:
InChI=1S/C10H18N2S/c1-4-8-7-10(5-2,6-3)12-9(13)11-8/h7H,4-6H2,1-3H3,(H2,11,12,13)
InChI Key:
BYFZEDXTRPDXLZ-UHFFFAOYSA-N
SMILES:
CCC1=CC(NC(=S)N1)(CC)CC
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.119g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
198.328g/mol
Monoisotopic Mass:
198.119g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
56.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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