89607-20-5
1-METHYL-3-NITRO-1H-PYRROLE-2-CARBOXYLIC ACID
Name
1-METHYL-3-NITRO-1H-PYRROLE-2-CARBOXYLIC ACID
Formula
C6 H6 N2 O4
MolWeight
170.123
1Identification
【Name】
1-METHYL-3-NITRO-1H-PYRROLE-2-CARBOXYLIC ACID
【CAS】
【MDL】
MFCD11844794
【English Synonyms】
【Formula】
C6 H6 N2 O4
【MolWeight】
170.123
【Inchi】
InChI=1S/C6H6N2O4/c1-7-3-2-4(8(11)12)5(7)6(9)10/h2-3H,1H3,(H,9,10)
【InChIKey】
InChIKey=IVKKDQRZYWIUIS-UHFFFAOYSA-N
【SMILES】
Cn1ccc(c1C(=O)O)[N+](=O)[O-]
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-METHYL-3-NITRO-1H-PYRROLE-2-CARBOXYLIC ACID.cml
Quick Release
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Country/Region:China
Business Type:Trading Company
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Catalog No:DB-078455 5G
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