3,4-Methylenedioxyphenyl isothiocyanate

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Names

[ CAS No. ]:
113504-93-1

[ Name ]:
3,4-Methylenedioxyphenyl isothiocyanate

[Synonym ]:
MFCD00066321
5-isothiocyanato-1,3-benzodioxole

Chemical & Physical Properties

[ Density]:
1.37 g/cm3

[ Boiling Point ]:
311.2ºC at 760 mmHg

[ Melting Point ]:
57ºC

[ Molecular Formula ]:
C8H5NO2S

[ Molecular Weight ]:
179.19600

[ Flash Point ]:
142ºC

[ Exact Mass ]:
179.00400

[ PSA ]:
62.91000

[ LogP ]:
2.14960

[ Vapour Pressure ]:
0.00104mmHg at 25°C

[ Index of Refraction ]:
1.646

[ Storage condition ]:
Keep cold

MSDS

Click to get detail MSDS

Safety Information

[ Hazard Codes ]:
T: Toxic;Xi: Irritant;

[ Risk Phrases ]:
R20/21/22

[ Safety Phrases ]:
26-36/37/39

[ RIDADR ]:
UN 2811

[ HS Code ]:
2932999099

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Thiophosgene
  • Benzo[d][1,3]dioxol-5-amine hydrochloride

DownStream

  • 1-(3,4-DIMETHYLPHENYL)-1H-PYRROLE-2,5-DIONE

Customs

[ HS Code ]: 2932999099

[ Summary ]:
2932999099. other heterocyclic compounds with oxygen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Related Compounds

  • 3,4-methylenedioxyphenyl triflate
  • (3,4-methylenedioxyphenyl)methyl trichloroacetimidate
  • 3,4-methylenedioxyphenyl propargyl ether
  • 3,4-Methylenedioxyphenyl ethyl ketone
  • 3,4-methylenedioxyphenyl mesylate
  • bromo(3,4-methylenedioxyphenyl)-acetic acid methyl ester
  • 2-Benzoyl-4-methylbenzoic acid
  • 2-(Difluoromethyl)-6-hydroxy-4-methylpyridine
  • 2-Methyl-N1-(3-pyridinylmethyl)-1,2-propanediamine
  • 5-(2-Methoxyethyl)benzo[b]thiophene
  • 1-(4-Chlorophenyl)-2-methyl-5-phenyl-n-piperidin-1-yl-1h-pyrrole-3-carboxamide
  • Propanamide, 3-chloro-N-1H-indazol-5-yl-
  • (E,E)-4,4''-Bi(N-4-hydroxycinnamoylserotonin)
  • 2'-Hydroxygenistein-7-O-glucoside
  • 5-Isopropyl-4-(3-methoxycarbamoyl-phenylamino)-pyrrolo[2,1-f][1,2,4]triazine-6-carboxylic acid ethyl ester
  • Azepan-1-yl(4-bromo-1H-pyrrol-2-yl)methanone
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