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14068-64-5 | 2(1H)-Pyrimidinone, tetrahydro-4-hydroxy-5,5-dimethyl-6-(1-methylethyl)-
CAS No: 14068-64-5 Catalog No: AG001COO MDL No:
Product Description
Catalog Number:
AG001COO
Chemical Name:
2(1H)-Pyrimidinone, tetrahydro-4-hydroxy-5,5-dimethyl-6-(1-methylethyl)-
CAS Number:
14068-64-5
Molecular Formula:
C9H18N2O2
Molecular Weight:
186.2514
IUPAC Name:
4-hydroxy-5,5-dimethyl-6-propan-2-yl-1,3-diazinan-2-one
InChI:
InChI=1S/C9H18N2O2/c1-5(2)6-9(3,4)7(12)11-8(13)10-6/h5-7,12H,1-4H3,(H2,10,11,13)
InChI Key:
ZRAXXNFGAHLING-UHFFFAOYSA-N
SMILES:
O=C1NC(O)C(C(N1)C(C)C)(C)C
EC Number:
237-923-5
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.137g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
186.255g/mol
Monoisotopic Mass:
186.137g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
61.4A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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