708285-81-8
1-([(3-METHOXYPHENYL)SULFONYL]AMINO)CYCLOHEXANECARBOXYLIC ACID
Name
1-([(3-METHOXYPHENYL)SULFONYL]AMINO)CYCLOHEXANECARBOXYLIC ACID
Formula
C14 H19 N O5 S
MolWeight
313.372
1Identification
【Name】
1-([(3-METHOXYPHENYL)SULFONYL]AMINO)CYCLOHEXANECARBOXYLIC ACID
【CAS】
【MDL】
MFCD05992776
【English Synonyms】
【Formula】
C14 H19 N O5 S
【MolWeight】
313.372
【Inchi】
InChI=1S/C14H19NO5S/c1-20-11-6-5-7-12(10-11)21(18,19)15-14(13(16)17)8-3-2-4-9-14/h5-7,10,15H,2-4,8-9H2,1H3,(H,16,17)
【InChIKey】
InChIKey=JYRASMNKLRBLFE-UHFFFAOYSA-N
【SMILES】
COc1cccc(c1)S(=O)(=O)NC2(CCCCC2)C(=O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:6
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-([(3-METHOXYPHENYL)SULFONYL]AMINO)CYCLOHEXANECARBOXYLIC ACID.cml
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