773871-57-1
1H-PYRROLE-2-CARBOXYLIC ACID, 4-(HYDROXYMETHYL)-1-METHYL-, METHYL ESTER
Name
1H-PYRROLE-2-CARBOXYLIC ACID, 4-(HYDROXYMETHYL)-1-METHYL-, METHYL ESTER
Formula
C8 H11 N O3
MolWeight
169.179
1Identification
【Name】
1H-PYRROLE-2-CARBOXYLIC ACID, 4-(HYDROXYMETHYL)-1-METHYL-, METHYL ESTER
【CAS】
【MDL】
MFCD06202993
【English Synonyms】
【Formula】
C8 H11 N O3
【MolWeight】
169.179
【Inchi】
InChI=1S/C8H11NO3/c1-9-4-6(5-10)3-7(9)8(11)12-2/h3-4,10H,5H2,1-2H3
【InChIKey】
InChIKey=CHKXRNGKOVCHRI-UHFFFAOYSA-N
【SMILES】
Cn1cc(cc1C(=O)OC)CO
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1H-PYRROLE-2-CARBOXYLIC ACID, 4-(HYDROXYMETHYL)-1-METHYL-, METHYL ESTER.cml
Quick Release
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