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4-Methoxycarbonylphenyl isothiocyanate

CAS#[3662-78-0]
G-codeGEO-01676
Molecular formulaC9H7NO2S
Molecular weight193.22
Synonyms Methyl 4-isothiocyanatobenzoate
Structure of 4-Methoxycarbonylphenyl isothiocyanate

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Specification

Appearancewhite crystalline powder
Purity99,8% (GC)

Structural identification

CAS#[3662-78-0]
G-codeGEO-01676
SMILESO=C(OC)C1=CC=C(N=C=S)C=C1
InChIInChI=1S/C9H7NO2S/c1-12-9(11)7-2-4-8(5-3-7)10-6-13/h2-5H,1H3
InChI KeyInChIKey=WIZODHILGBTPPA-UHFFFAOYSA-N
Download structure as .mol

Regulatory Information

Transport InformationCORROSIVE SOLID, TOXIC, N.O.S. UN2923 8 (6.1)/ PG III
GHS pictogram
GHS06_toxicGHS05_corrosive
Signal WordDanger
Hazard Statements
H302 - H312 - H331 - H314

H302 – Harmful if swallowed
H312 – Harmful in contact with skin
H314 – Causes severe skin burns and eye damage
H331 – Toxic if inhaled

Precautionary Statements
P280 - P303+361+353 - P305+351+338 - P309 - P310

P280 – Wear protective gloves/protective clothing/eye protection/face protection:
P303+361+353 – IF ON SKIN (or hair): Remove/Take off immediately all contaminated clothing. Rinse skin with water/shower
P305+351+338 – IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses if present and easy to do – continue rinsing
P309 – IF exposed or you feel unwell:
P310 – Immediately call a POISON CENTER or doctor/physician:

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