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CAS No.: | 106-53-6 |
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Name: | 4-Bromothiophenol |
Article Data: | 80 |
Molecular Structure: | |
Formula: | C6H5BrS |
Molecular Weight: | 189.076 |
Synonyms: | Benzenethiol,p-bromo- (6CI,7CI,8CI);1-Bromo-4-mercaptobenzene;4-Bromobenzenethiol;4-Bromophenylthiol;NSC 229563;NSC 32018;p-Bromobenzenethiol;p-Bromophenyl thiol;p-Bromothiophenol;Benzenethiol, 4-bromo-; |
EINECS: | 203-407-3 |
Density: | 1.599 g/cm3 |
Melting Point: | 73-76 °C |
Boiling Point: | 231.3 °C at 760 mmHg |
Flash Point: | 93.7 °C |
Solubility: | Slightly soluble in water |
Appearance: | White to light yellow crystal powder |
Hazard Symbols: | TC |
Risk Codes: | R36/37/38 |
Safety: | 26-36 |
Transport Information: | UN 3335 |
PSA: | 38.80000 |
LogP: | 2.73780 |
IUPAC Name: 4-Bromobenzenethiol
Canonical SMILES: C1=CC(=CC=C1S)Br
InChI: InChI=1S/C6H5BrS/c7-5-1-3-6(8)4-2-5/h1-4,8H
InChIKey: FTBCOQFMQSTCQQ-UHFFFAOYSA-N
Molecular Weight: 189.0729 [g/mol]
Molecular Formula: C6H5BrS
XLogP3: 3.2
EINECS: 203-407-3
Melting Point: 73-76 °C(lit.)
Index of Refraction: 1.63
Molar Refractivity: 42.11 cm3
Molar Volume: 118.2 cm3
Surface Tension: 45 dyne/cm
Density: 1.599 g/cm3
Flash Point: 93.7 °C
Enthalpy of Vaporization: 44.89 kJ/mol
Boiling Point: 231.3 °C at 760 mmHg
Vapour Pressure: 0.0954 mmHg at 25 °C
Appearance: White to light yellow crystal powder
storage temp.: Refrigerator
Sensitive: Air Sensitive
Product Categories of 4-Bromothiophenol (CAS NO.106-53-6): Phenyls & Phenyl-Het; Phenol & Thiophenol & Mercaptan ;Miscellaneous; Phenyls & Phenyl-Het
Hazard Codes: Xi,T,C
Risk Statements: 36/37/38
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36:Wear suitable protective clothing.
RIDADR: 2923
WGK Germany: 3
F: 10-13-23
Hazard Note: Irritant
TSCA: T
HazardClass: 8
PackingGroup of 4-Bromothiophenol (CAS NO.106-53-6): III
4-Bromothiophenol (CAS NO.106-53-6), its Synonyms are 4-Bromobenzenethiol ; p-Bromobenzenethiol ; p-Bromophenyl thiol ; p-Bromothiophenol ; Benzenethiol, 4-bromo- ; Benzenethiol, p-bromo- (8CI) .