57109-17-8
2,5-DIMETHYL-PYRIMIDO[2,1,6-CD]PYRROLIZINE-4-CARBOXALDEHYDE
Name
2,5-DIMETHYL-PYRIMIDO[2,1,6-CD]PYRROLIZINE-4-CARBOXALDEHYDE
Formula
C12 H10 N2 O
MolWeight
198.224
1Identification
【Name】
2,5-DIMETHYL-PYRIMIDO[2,1,6-CD]PYRROLIZINE-4-CARBOXALDEHYDE
【CAS】
【MDL】
MFCD21362933
【English Synonyms】
【Formula】
C12 H10 N2 O
【MolWeight】
198.224
【Inchi】
InChI=1S/C12H10N2O/c1-7-5-11-9(6-15)8(2)10-3-4-12(13-7)14(10)11/h3-6H,1-2H3
【InChIKey】
InChIKey=SXMDLEJOOHDOOX-UHFFFAOYSA-N
【SMILES】
Cc1cc2c(c(c3n2c(n1)cc3)C)C=O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2,5-DIMETHYL-PYRIMIDO[2,1,6-CD]PYRROLIZINE-4-CARBOXALDEHYDE.cml
Quick Release
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[2-(4-METHYLPHENYL)-1-(OXAN-3-YL)ETHYL](PROPYL)AMINE
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