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862254-43-1
3-(2-AMINO-4-THIAZOLYL)BENZOIC ACID
Name
3-(2-AMINO-4-THIAZOLYL)BENZOIC ACID
Formula
C10 H8 N2 O2 S
MolWeight
220.251
1Identification
【Name】
3-(2-AMINO-4-THIAZOLYL)BENZOIC ACID
【CAS】
【MDL】
MFCD12196529
【English Synonyms】
【Formula】
C10 H8 N2 O2 S
【MolWeight】
220.251
【Inchi】
InChI=1S/C10H8N2O2S/c11-10-12-8(5-15-10)6-2-1-3-7(4-6)9(13)14/h1-5H,(H2,11,12)(H,13,14)
【InChIKey】
InChIKey=FUVRHVASGCIPSM-UHFFFAOYSA-N
【SMILES】
c1cc(cc(c1)C(=O)O)c2csc(n2)N
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:4
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-(2-AMINO-4-THIAZOLYL)BENZOIC ACID.cml
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