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4-Methylphenyl Isothiocyanate

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Product Description

PRODUCT

4-Methylphenyl Isothiocyanate

CAS #

622-59-3

SYNONYM

4-Tolyl isothiocyanate; 4-12-00-01938 (Beilstein Handbook Reference); p-Tolyl isothiocyanate; 4-Methylphenyl isothiocyanate; p-Methylphenyl isothiocyanate; EINECS 210-745-5; 1-Isothiocyanato-4-methylbenzene; 4-Tolylisothiocyanate; Isothiocyanic acid, p-tolyl ester; Isothiocyanic acid, 4-tolyl ester; BRN 0386032

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FORMULA

C8H7NS

HAZARD

8 corrosive

Typical Product Specifications

MOLECULAR WEIGHT

149.21

SMILES

c1(ccc(C)cc1)N=C=S

INCHI

1S/C8H7NS/c1-7-2-4-8(5-3-7)9-6-10/h2-5H,1H3

INCHIKEY

ABQKHKWXTUVKGF-UHFFFAOYSA-N

HENRY'S LAW CONSTANT

8.62E-04 atm-m3/mole

LOG P (OCTANOL-WATER)

3.92

BOILING POINT

237 ° C

ATMOSPHERIC OH RATE CONSTANT

5.72E-12 cm3/molecule-sec

VAPOR PRESSURE

0.030 mm Hg

WATER SOLUBILITY

2.84 mg/L

MELTING POINT

25-26 ° C

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