ChemicalBook CAS DataBase List 80756-85-0

80756-85-0

Name	S-2-Benzothiazolyl 2-amino-alpha-(methoxyimino)-4-thiazolethiolacetate
CAS	80756-85-0
EINECS(EC#)	279-540-6
Molecular Formula	C13H10N4O2S3
MDL Number	MFCD00134182
Molecular Weight	350.44
MOL File	80756-85-0.mol

Synonyms

S-2-BENZATHIAZOYL-2-AMINO-ALPHA-METHOXYIMINO-4-THIAZOLACETAT S-2-BENZOTHIAZOYL-2-AMINO-ALPHA-METHOXYIMINO-4-THIAZOLEACETATE (2-mercaptobenzothiazolyl)-2-(2-aminothiazol-4-yl)-2-methoxyiminoacetate(syn 2-(2-amino-4-thiazole)-2-methoxyiminoacetic,thiobenzothiazoleester 2-(2-Amino-4-thiazolyl)-2-methoxyiminoacetic,thiobenzothiazoleester 2-amino-alpha-(methoxyimino)-4-thiazoleethanethioicacis-2-benzothiazolyl s-2-benzothiazolyl(z)-2-amino-alpha-(methoxyimino)-4-thiazoleethanethioate s-benzothiazol-2-yl(z)-2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)thioacet 2-MERCAPTOBENZOTHIAZOLYL(Z)-2-AMINOTHIAZOLE-4-YL-2-METHOXY IMINO ACETATE(MAEM) Ceftriaxone Sodium intermediate S-benzothiazol-2-yl (Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)thioacetate S-2-Benzothiazoyl-2-amino-alpha-methoxyimino-4-thiazoleacetate(MAEM) S-2-benzothiazoyl-2-amino-α-methoxyimino-4-thiazoleacetate (Benzothiazol-2-yl)-(Z)-2-methoxyimino-2-(2-amino-thiozol-4-yl) thioacetate S-2-Benzothiazolyl-2-amino-alpha-(methoxyimino)-4-thiazolethioacetate 2-Mercaptobenzothiazolyl (2-Aminothiazolyl)-Methoxyimino Acetate (BENZOTHIAZOL-2-YL)-2-(2-AMINOTHIZAZOL-4-YL)-(Z)-2-METHOXYIMINO THIOACETATE 2-Amino-α-(methoxyimino)-4-thiazoleethanethioic acid, S-2-benzothiazolyl ester S-(Benzothiazol-2-yl) (Z)-(2-aminothiazol-4-yl) (methoxyimino) thioacetate S-(Benzothiazol-2-yl) 2-amino-α-(methoxyimino) thiazole-4-thioacetate

Chemical Properties

Appearance	light yellow powder
Melting point	128-130 °C(lit.)
Boiling point	563.2±42.0 °C(Predicted)
density	1.63
refractive index	1.6200 (estimate)
storage temp.	Refrigerator, Under Inert Atmosphere
solubility	Chloroform (Slightly), Methanol (Slightly)
form	Solid
pka	1.22±0.10(Predicted)
color	Pale Yellow
Stability:	Moisture Sensitive
Major Application	pharmaceutical small molecule
InChI	InChI=1S/C13H10N4O2S3/c1-19-17-10(8-6-20-12(14)15-8)11(18)22-13-16-7-4-2-3-5-9(7)21-13/h2-6H,1H3,(H2,14,15)/b17-10-
InChIKey	COFDRZLHVALCDU-YVLHZVERSA-N
SMILES	S(C1SC2C=CC=CC=2N=1)C(=O)/C(/C1N=C(N)SC=1)=N\OC
CAS DataBase Reference	80756-85-0(CAS DataBase Reference)

Safety Data

Hazard Codes	Xi
Risk Statements	R36/37/38:Irritating to eyes, respiratory system and skin . less more
Safety Statements	S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice . S37/39:Wear suitable gloves and eye/face protection . less more
WGK Germany	2
RTECS	XJ4664500
HS Code	2934.20.8000
REACH Registrations	Active

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