AG003HVX

7113-10-2 | 2-Phenylthiazole-4-carboxylic acid

AG003HVX

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CAS Number	7113-10-2
Catalog Number	AG003HVX(AGN-PC-0JMQFX)
Chemical Name	2-Phenylthiazole-4-carboxylic acid
IUPAC Name	2-phenyl-1,3-thiazole-4-carboxylic acid
InChI	InChI=1S/C10H7NO2S/c12-10(13)8-6-14-9(11-8)7-4-2-1-3-5-7/h1-6H,(H,12,13)
InChI Key	IBUSLNJQKLZPNR-UHFFFAOYSA-N
MDL Number	MFCD00141954
Molecular Formula	C10H7NO2S
Molecular Weight	205.2331
SMILES	O=C(C1=CSC(C2=CC=CC=C2)=N1)O
Synonyms	2-Phenylthiazole-4-carboxylic Acid, 7113-10-2, 2-phenyl-1,3-thiazole-4-carboxylic acid, 2-Phenyl-4-carboxythiazole, 4-Thiazolecarboxylic acid, 2-phenyl-, MLS000773831, 2-Phenyl-thiazole-4-carboxylic acid, MFCD00141954, SMR000364704, SDCCGMLS-0066001.P001, PubChem19074, AC1L3DVY, 4-carboxy-2-phenylthiazole, Oprea1_695170, KSC237I8R, SCHEMBL352152, AC1Q742E, cid_138928, CHEMBL1406848, BDBM63710, DTXSID60221330, IBUSLNJQKLZPNR-UHFFFAOYSA-N, HMS1732M09, HMS2748I03, HT712, ZINC158872, BCP27264, KS-00000N7H, KS-000030NF, ANW-47040, CP-026, SBB059004, STL352653, VT1249, AKOS001121372, AB03809, ACN-051808, CS-W003986, MCULE-1700464705, phenyl-1,3-thiazole-4-carboxylic acid, RP04527, TRA0072359, NCGC00246130-01, 12F-317S, 2-phenyl-1.3-thiazole-4-carboxylic acid, AC-28029, AJ-15379, AK-22021, BP-10667, BR-22021, SC-30600, 2-PHENYL-4-THIAZOLECARBOXYLIC ACID, DB-025925, ST2417169, TR-023441, 4CH-015302, AM20041062, FT-0660542, ST51043304, W8018, A19576, C-4063, 7113-10-2 2-Phenyl-thiazole-4-carboxylic acid, 2-PHENYL-1,3-THIADIAZOLE-4-CARBOXYLIC ACID, J-510274, 2-phenyl-1,3-thiazole-4-carboxylic acid, AldrichCPR, I14-20371, Z56756826, F2147-0618, C10H7NO2S, CID138928, 2-Dimethylamino-2-hydroxymethylpropane-1,3-diol, 2-Phenylthiazole-4-carboxylic acid, 97% - 1G 1g,

Complexity	216
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	205.02g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	205.231g/mol
Monoisotopic Mass	205.02g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	78.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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