873378-07-5
1,4-BENZODIOXAN-5-CARBOXYLIC ACID, 6-HYDROXY-
Name1,4-BENZODIOXAN-5-CARBOXYLIC ACID, 6-HYDROXY-
1Identification
【Name】
1,4-BENZODIOXAN-5-CARBOXYLIC ACID, 6-HYDROXY-
【CAS】
【MDL】
MFCD16878757
【English Synonyms】
【Formula】
C9 H8 O5
【MolWeight】
196.157
【Inchi】
InChI=1S/C9H8O5/c10-5-1-2-6-8(7(5)9(11)12)14-4-3-13-6/h1-2,10H,3-4H2,(H,11,12)
【InChIKey】
InChIKey=JIRJNRNKJIUAGM-UHFFFAOYSA-N
【SMILES】
c1cc2c(c(c1O)C(=O)O)OCCO2
【MOL File】
1,4-BENZODIOXAN-5-CA….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:5
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1,4-BENZODIOXAN-5-CARBOXYLIC ACID, 6-HYDROXY-.cml