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13747-15-4 | 2(1H)-Pyrimidinone, tetrahydro-1,3-bis(methoxymethyl)-
CAS No: 13747-15-4 Catalog No: AG0013CH MDL No:
Product Description
Catalog Number:
AG0013CH
Chemical Name:
2(1H)-Pyrimidinone, tetrahydro-1,3-bis(methoxymethyl)-
CAS Number:
13747-15-4
Molecular Formula:
C8H16N2O3
Molecular Weight:
188.2242
IUPAC Name:
1,3-bis(methoxymethyl)-1,3-diazinan-2-one
InChI:
InChI=1S/C8H16N2O3/c1-12-6-9-4-3-5-10(7-13-2)8(9)11/h3-7H2,1-2H3
InChI Key:
UZOPFGGJIFOEEY-UHFFFAOYSA-N
SMILES:
COCN1CCCN(C1=O)COC
Properties
Complexity:
159
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.116g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.227g/mol
Monoisotopic Mass:
188.116g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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