5104-61-0
4H,6H-PYRIMIDO[1,6-C][1,3]BENZOXAZIN-4-ONE,1,2,3,11B-TETRAHYDRO-2,8,10-TRIMETHYL-6-(3-METHYLBUTYL)-
Name
4H,6H-PYRIMIDO[1,6-C][1,3]BENZOXAZIN-4-ONE,1,2,3,11B-TETRAHYDRO-2,8,10-TRIMETHYL-6-(3-METHYLBUTYL)-
Formula
C19 H28 N2 O2
MolWeight
316.442
1Identification
【Name】
4H,6H-PYRIMIDO[1,6-C][1,3]BENZOXAZIN-4-ONE,1,2,3,11B-TETRAHYDRO-2,8,10-TRIMETHYL-6-(3-METHYLBUTYL)-
【CAS】
【MDL】
MFCD21607658
【English Synonyms】
【Formula】
C19 H28 N2 O2
【MolWeight】
316.442
【Inchi】
InChI=1S/C19H28N2O2/c1-6-7-12(3)18-21-16(10-14(5)20-19(21)22)15-9-11(2)8-13(4)17(15)23-18/h8-9,12,14,16,18H,6-7,10H2,1-5H3,(H,20,22)
【InChIKey】
InChIKey=FIEIEHZOKLOKHZ-UHFFFAOYSA-N
【SMILES】
CCCC(C)C1N2C(CC(NC2=O)C)c3cc(cc(c3O1)C)C
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4H,6H-PYRIMIDO[1,6-C][1,3]BENZOXAZIN-4-ONE,1,2,3,11B-TETRAHYDRO-2,8,10-TRIMETHYL-6-(3-METHYLBUTYL)-.cml
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