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Name |
2-Amino-4-chlorothiophenol |
EINECS | N/A |
CAS No. | 1004-00-8 | Density | 1.372 g/cm3 |
PSA | 64.82000 | LogP | 2.79210 |
Solubility | Practically insoluble in water | Melting Point |
56-61 °C(lit.) |
Formula | C6H6ClNS | Boiling Point | 281.2 °C at 760 mmHg |
Molecular Weight | 159.639 | Flash Point | 123.9 °C |
Transport Information | UN 3261 8/PG 3 | Appearance | Light yellow crystals |
Safety | 26-36 | Risk Codes | 36/37/38 |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
2-Amino-4-chlorobenzenethiol;4-Chloro-2-aminobenzothiol;4-Chloro-2-aminothiophenol; |
Article Data | 27 |
IUPAC Name: 2-Amino-4-chlorobenzenethiol
Canonical SMILES: C1=CC(=C(C=C1Cl)N)S
InChI: InChI=1S/C6H6ClNS/c7-4-1-2-6(9)5(8)3-4/h1-3,9H,8H2
InChIKey: NGIRMPARLVGMPX-UHFFFAOYSA-N
Molecular Weight: 159.63654 [g/mol]
Molecular Formula: C6H6ClNS
XLogP3: 2.4
H-Bond Donor: 1
H-Bond Acceptor: 1
Sensitive: Stench
Appearance: Light yellow crystals
Melting Point: 56-61 °C(lit.)
Index of Refraction: 1.672
Molar Refractivity: 43.55 cm3
Molar Volume: 116.2 cm3
Surface Tension: 55.5 dyne/cm
Density: 1.372 g/cm3
Flash Point: 123.9 °C
Enthalpy of Vaporization: 52 kJ/mol
Boiling Point: 281.2 °C at 760 mmHg
Vapour Pressure: 0.00361 mmHg at 25 °C
Product Categories of Benzenethiol,2-amino-4-chloro- (CAS NO.1004-00-8): Sulphur Derivatives; Phenol & Thiophenol & Mercaptan; Phenoles and thiophenoles; Organic Building Blocks; Sulfur Compounds; Thiols / Mercaptans
Hazard Codes: Xi
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: UN 3261 8/PG 3
WGK Germany: 3
Hazard Note of Benzenethiol,2-amino-4-chloro- (CAS NO.1004-00-8): Irritant / Stench
Benzenethiol,2-amino-4-chloro- (CAS NO.1004-00-8), its Synonyms are 2-Amino-4-chlorobenzenethiol ; 2-Amino-4-chlorothiophenol ; 4-Chloro-2-aminothiophenol ; 4-Chloro-2-aminobenzothiol .