1227382-04-8
4-(3-(AMINOOXY)PROP-1-YNYL)BENZOIC ACID HYDROBROMIDE
Name4-(3-(AMINOOXY)PROP-1-YNYL)BENZOIC ACID HYDROBROMIDE
FormulaC10 H9 N O3 . Br H
1Identification
【Name】
4-(3-(AMINOOXY)PROP-1-YNYL)BENZOIC ACID HYDROBROMIDE
【CAS】
【MDL】
MFCD17012874
【English Synonyms】
【Formula】
C10 H9 N O3 . Br H
【MolWeight】
272.097
【Inchi】
InChI=1S/C10H9NO3.BrH/c11-14-7-1-2-8-3-5-9(6-4-8)10(12)13;/h3-6H,7,11H2,(H,12,13);1H
【InChIKey】
InChIKey=APMILRZAJQXCRR-UHFFFAOYSA-N
【SMILES】
c1cc(ccc1C#CCON)C(=O)O.Br
【MOL File】
4-(3-(AMINOOXY)PROP-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:4
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-(3-(AMINOOXY)PROP-1-YNYL)BENZOIC ACID HYDROBROMIDE.cml