Benzoic acid,4-isothiocyanato-, ethyl ester

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Names

[ CAS No. ]:
1205-06-7

[ Name ]:
Benzoic acid,4-isothiocyanato-, ethyl ester

[Synonym ]:
4-Isothiocyanato-Benzoic Acid Ethyl Ester
4-ETHOXYCARBONYLPHENYL-ISOTHIOCYANATE
ethyl p-isothiocyanatobenzoate
p-ethoxycarbonylphenyl isothiocyanate
4-carbethoxyphenyl isothiocyanate
4-carboethoxy-phenylisothiocyanate
EINECS 214-880-0
MFCD00022058
4-Isothiocyanatobenzoesaeure-ethylester
Benzoic acid,4-isothiocyanato-,ethyl ester

Chemical & Physical Properties

[ Density]:
1.14 g/cm3

[ Boiling Point ]:
123-127°C 1mm

[ Melting Point ]:
57 °C

[ Molecular Formula ]:
C10H9NO2S

[ Molecular Weight ]:
207.24900

[ Flash Point ]:
123-127°C/1mm

[ Exact Mass ]:
207.03500

[ PSA ]:
70.75000

[ LogP ]:
2.59760

[ Vapour Pressure ]:
0.000201mmHg at 25°C

[ Index of Refraction ]:
1.558

Safety Information

[ Hazard Codes ]:
C,T,Xi

[ Risk Phrases ]:
R20/21/22;R36/37/38

[ Safety Phrases ]:
S26-S36/37/39

[ RIDADR ]:
2811

[ Packaging Group ]:
II

[ Hazard Class ]:
6.1

[ HS Code ]:
2930909090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Thiophosgene
  • Benzocaine
  • Bis(1-benzotriazolyl)methanethione
  • Triphosgene
  • O,O-Di-2-pyridinyl carbonothioate
  • 4-Aminobenzoic acid

DownStream

  • Benzoic acid,4,4'-(carbonothioyldiimino)bis-, diethyl ester (9CI)
  • ethyl 4-(ethylthiocarbamoylamino)benzoate
  • ethyl 4-(aminocarbamothioylamino)benzoate
  • Benzoic acid,4-[(aminothioxomethyl)amino]-, ethyl ester
  • ethyl 4-(1,3-thiazol-2-ylthiocarbamoylamino)benzoate

Customs

[ HS Code ]: 2930909090

[ Summary ]:
2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

Related Compounds

  • 4-Ethoxycarbonyl-2-fluorophenylisothiocyanate
  • 4-Ethoxycarbonyl-2-chlorophenylisothiocyanate
  • Methyl 4-(isothiocyanatomethyl)benzoate
  • Benzoic acid,4-(formylamino)-, ethyl ester
  • Benzoic acid,4-(methylsulfonyl)-, ethyl ester
  • Benzoic acid,4-(nonylamino)-, ethyl ester
  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • 3-{[(Benzyloxy)carbonyl]amino}-5-{[(tert-butoxy)carbonyl]amino}-4-methylpentanoic acid
  • (4-Methyl-tetrahydro-furan-2-yl)-methanol
  • 3-(5-Chlorofuran-2-yl)-4,4-difluorobutanoic acid
  • 6-(Fluoro-18F)-2-naphthoic acid
  • N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide
  • 2-(ethylamino)-3-(4-propyl-1H-pyrazol-1-yl)propanoic acid