Methyl 2-isocyanatobenzoate

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Names

[ CAS No. ]:
1793-07-3

[ Name ]:
Methyl 2-isocyanatobenzoate

[Synonym ]:
MFCD00013848
2-isocyanato-benzoic acid methyl ester
methyl 2-(isocyanato)benzoate
2-Methoxycarbonylphenyl isocyanate
Benzoic acid, 2-isocyanato-, methyl ester
2-(METHOXYCARBONYL)PHENYL ISOCYANATE
2-Carbomethoxyphenyl isocyanate
Methyl 2-isocyanatobenzoate

Chemical & Physical Properties

[ Density]:
1.2±0.1 g/cm3

[ Boiling Point ]:
267.1±23.0 °C at 760 mmHg

[ Melting Point ]:
45-49ºC

[ Molecular Formula ]:
C9H7NO3

[ Molecular Weight ]:
177.157

[ Flash Point ]:
124.8±17.1 °C

[ Exact Mass ]:
177.042587

[ PSA ]:
55.73000

[ LogP ]:
3.37

[ Appearance of Characters ]:
Solid or Crystalline Solid | White to off-white

[ Vapour Pressure ]:
0.0±0.5 mmHg at 25°C

[ Index of Refraction ]:
1.529

[ Storage condition ]:
2-8℃

[ Water Solubility ]:
Hydrolyzes in water.

MSDS

Click to get detail MSDS

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H302-H312-H315-H319-H332-H335

[ Precautionary Statements ]:
P261-P280-P305 + P351 + P338

[ Personal Protective Equipment ]:
dust mask type N95 (US);Eyeshields;Gloves

[ Hazard Codes ]:
Xn: Harmful;Xi: Irritant;

[ Risk Phrases ]:
R20/22;R36/37/38;R42

[ Safety Phrases ]:
S22-S26-S36/37/39-S45

[ RIDADR ]:
UN 2811

[ WGK Germany ]:
3

[ Packaging Group ]:
III

[ Hazard Class ]:
6.1

[ HS Code ]:
2929109000

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Triphosgene
  • Methyl 2-aminobenzoate
  • phosgene
  • 4-Nitrophenyl chloroformate
  • Monomethyl phthalate

DownStream

  • 3-CarboxyMethyl-quinazoline-2,4-dione
  • 2-(propylamino)-3,1-benzoxazin-4-one
  • methyl 2-(propan-2-ylcarbamoylamino)benzoate
  • Benzoic acid,2-[[[(2-chlorophenyl)amino]carbonyl]amino]-, methyl ester
  • Tryptanthrine
  • Isatoic anhydride
  • Benzoic acid,2-[[(methylamino)carbonyl]amino]-, methyl ester
  • methyl 2-(methoxycarbonylamino)benzoate
  • 2,4(1H,3H)-Quinazolinedione, 3-(4-morpholinyl)-
  • N-(2,4-dioxo-1H-quinazolin-3-yl)benzamide

Customs

[ HS Code ]: 2929109000

[ Summary ]:
2929109000. other isocyanates. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

Articles

Explorations of substituted urea functionality for the discovery of new activators of the heme-regulated inhibitor kinase.

J. Med. Chem. 56(23) , 9457-70, (2013)

Heme-regulated inhibitor kinase (HRI), a eukaryotic translation initiation factor 2 alpha (eIF2α) kinase, plays critical roles in cell proliferation, differentiation, and adaptation to cytoplasmic str...

Identification and characterization of a non-retinoid ligand for retinol-binding protein 4 which lowers serum retinol-binding protein 4 levels in vivo.

J. Biol. Chem. 284 , 7673-7680, (2009)

Retinol-binding protein 4 (RBP4) transports retinol from the liver to extrahepatic tissues, and RBP4 lowering is reported to improve insulin sensitivity in mice. We have identified A1120, a high affin...

ortho-Lithiophenyl isocyanide: a versatile precursor for 3H-quinazolin-4-ones and 3H-quinazolin-4-thiones.

Org. Lett. 11(2) , 389-92, (2009)

ortho-Lithiophenyl isocyanide has been generated from ortho-bromophenyl isocyanide and successfully employed toward the synthesis of 2-substituted phenyl isocyanides as well as 2,3-disubstituted 3H-qu...


More Articles

Related Compounds

  • methyl 6-ethyl-2-isocyanatobenzoate
  • Methyl 2-(2-chlorophenyl)-2-(4,5-dihydrothieno[2,3-c]pyridin-6(7H)-yl)acetate
  • Methyl 2-Boc-aminothiazole-4-carboxylate
  • Methyl 2-Aminopyrimidine-5-carboxylate
  • Methyl 2-(1-piperidinylmethyl)benzoate
  • METHYL 2-ACETYLAMINO-3-DIMETHYLAMINOPROPENOATE
  • 4-(1H-1,2,4-triazol-1-yl)pyridine hydrochloride
  • N-[(6-cyclopropylpyridin-3-yl)methyl]-4-methoxybenzamide
  • 1-(2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl)-4-(pyridin-3-ylsulfonyl)piperazine dihydrochloride
  • 1-(2-Bromobenzenesulfonyl)-4-(thiolan-3-yl)-1,4-diazepane
  • 1-(Thiolan-3-yl)-4-[4-(trifluoromethyl)benzenesulfonyl]-1,4-diazepane
  • 2-(4-(((6-cyclobutylpyrimidin-4-yl)oxy)methyl)piperidin-1-yl)-7,8-dihydro-5H-pyrano[4,3-b]pyridine-3-carbonitrile
  • 8-[1-(2-methoxyphenyl)cyclopropanecarbonyl]-3-(1H-pyrazol-1-yl)-8-azabicyclo[3.2.1]octane
  • 1-(3-methoxyphenyl)-4-(1-{5H,6H,7H-pyrazolo[3,2-b][1,3]oxazine-2-carbonyl}piperidin-4-yl)piperazine; trifluoroacetic acid
  • 4-[(3-Methylphenyl)methanesulfonyl]-1-(pyridin-2-yl)piperazin-2-one
  • N,1-dimethyl-N-(1-{[1,2,4]triazolo[4,3-b]pyridazin-6-yl}azetidin-3-yl)-1H-imidazole-4-carboxamide
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