56461-21-3
5-OXO-5,6,7,8-TETRAHYDRO-NAPHTHALENE-1-CARBOXYLIC ACID
Name
5-OXO-5,6,7,8-TETRAHYDRO-NAPHTHALENE-1-CARBOXYLIC ACID
Formula
C11 H10 O3
MolWeight
190.197
1Identification
【Name】
5-OXO-5,6,7,8-TETRAHYDRO-NAPHTHALENE-1-CARBOXYLIC ACID
【CAS】
【MDL】
MFCD02179285
【English Synonyms】
【Formula】
C11 H10 O3
【MolWeight】
190.197
【Inchi】
InChI=1S/C11H10O3/c12-10-6-2-3-7-8(10)4-1-5-9(7)11(13)14/h1,4-5H,2-3,6H2,(H,13,14)
【InChIKey】
InChIKey=RXCHZIBXSFNHPN-UHFFFAOYSA-N
【SMILES】
c1cc2c(c(c1)C(=O)O)CCCC2=O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:3
XLogP3:2.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
5-OXO-5,6,7,8-TETRAHYDRO-NAPHTHALENE-1-CARBOXYLIC ACID.cml
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