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4-(Isothiocyanatomethyl)Phenol
[CAS# 2086-86-4]

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Identification
Name 4-(Isothiocyanatomethyl)Phenol
Synonyms 4-Hydroxybenzyl Isothiocyanate; Phenol, 4-(Isothiocyanatomethyl)-; Para-Hydroxybenzyl Isothiocyanate
Molecular Structure CAS#: 2086-86-4, 4-(Isothiocyanatomethyl)Phenol
Molecular Formula C8H7NOS
Molecular Weight 165.21
CAS Registry Number 2086-86-4
SMILES S=C=NCC1=CC=C(C=C1)O
InChI 1S/C8H7NOS/c10-8-3-1-7(2-4-8)5-9-6-11/h1-4,10H,5H2
InChIKey ATKWJXUJUNLTFU-UHFFFAOYSA-N
Properties
Density 1.152g/cm3 (Cal.)
Boiling point 322.057°C at 760 mmHg (Cal.)
Flash point 148.575°C (Cal.)
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