857771-08-5
2,2-DIMETHYL-3-(4-NITROPHENYL)PROPANOIC ACID
Name
2,2-DIMETHYL-3-(4-NITROPHENYL)PROPANOIC ACID
Formula
C11 H13 N O4
MolWeight
223.227
1Identification
【Name】
2,2-DIMETHYL-3-(4-NITROPHENYL)PROPANOIC ACID
【CAS】
【MDL】
MFCD16855523
【English Synonyms】
【Formula】
C11 H13 N O4
【MolWeight】
223.227
【Inchi】
InChI=1S/C11H13NO4/c1-11(2,10(13)14)7-8-3-5-9(6-4-8)12(15)16/h3-6H,7H2,1-2H3,(H,13,14)
【InChIKey】
InChIKey=LPECYPCBIIJVFC-UHFFFAOYSA-N
【SMILES】
CC(C)(Cc1ccc(cc1)[N+](=O)[O-])C(=O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2,2-DIMETHYL-3-(4-NITROPHENYL)PROPANOIC ACID.cml
Quick Release
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Aldlab Chemicals, LLC
Catalog No:A212744 5G
Country/Region:United States
Business Type:Others
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Catalog No:A212744 5G
Country/Region:United States
Business Type:Others
http://www.aldlab.com
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