56015-73-7
4-ETHYNYL-3-METHYL-1H-PYRROLE-2-CARBALDEHYDE
Name4-ETHYNYL-3-METHYL-1H-PYRROLE-2-CARBALDEHYDE
1Identification
【Name】
4-ETHYNYL-3-METHYL-1H-PYRROLE-2-CARBALDEHYDE
【CAS】
【MDL】
MFCD11109715
【English Synonyms】
【Formula】
C8 H7 N O
【MolWeight】
133.149
【Inchi】
InChI=1S/C8H7NO/c1-3-7-4-9-8(5-10)6(7)2/h1,4-5,9H,2H3
【InChIKey】
InChIKey=SETQGJWGEJYQTH-UHFFFAOYSA-N
【SMILES】
Cc1c(c[nH]c1C=O)C#C
【MOL File】
4-ETHYNYL-3-METHYL-1….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:2
XLogP3:1.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
4-ETHYNYL-3-METHYL-1H-PYRROLE-2-CARBALDEHYDE.cml