o-(2-Benzothiazolyl)phenol

Modify Date: 2024-01-02 12:16:45

o-(2-Benzothiazolyl)phenol Structure
o-(2-Benzothiazolyl)phenol structure
Common Name o-(2-Benzothiazolyl)phenol
CAS Number 3411-95-8 Molecular Weight 227.282
Density 1.3±0.1 g/cm3 Boiling Point 402.2±47.0 °C at 760 mmHg
Molecular Formula C13H9NOS Melting Point 128-132 °C(lit.)
MSDS Chinese USA Flash Point 197.0±29.3 °C
Symbol GHS07
GHS07
Signal Word Warning

 Names

Name 2-(2-Hydroxyphenyl)benzothiazole
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.3±0.1 g/cm3
Boiling Point 402.2±47.0 °C at 760 mmHg
Melting Point 128-132 °C(lit.)
Molecular Formula C13H9NOS
Molecular Weight 227.282
Flash Point 197.0±29.3 °C
Exact Mass 227.040482
PSA 61.36000
LogP 4.53
Vapour Pressure 0.0±1.0 mmHg at 25°C
Index of Refraction 1.719

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
SJ7360000
CHEMICAL NAME :
Phenol, 2-(2-benzothiazolyl)-
CAS REGISTRY NUMBER :
3411-95-8
BEILSTEIN REFERENCE NO. :
0173026
LAST UPDATED :
199701
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C13-H9-N-O-S
MOLECULAR WEIGHT :
227.29

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD - Lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>4 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
ANTCAO Antibiotics and Chemotherapy (Washington, DC). (Washington, DC) V.1-12, 1951-62. For publisher information, see CLMEA3. Volume(issue)/page/year: 8,33,1958

 Safety Information

Symbol GHS07
GHS07
Signal Word Warning
Hazard Statements H315-H319-H335
Precautionary Statements P261-P305 + P351 + P338
Personal Protective Equipment dust mask type N95 (US);Eyeshields;Gloves
Hazard Codes Xi:Irritant;
Risk Phrases R36/37/38
Safety Phrases S26-S37/39
RIDADR NONH for all modes of transport
WGK Germany 3
RTECS SJ7360000
HS Code 2934999090

 Customs

HS Code 2934999090
Summary 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Articles7

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The effect of hydrogen bonding on the excited-state proton transfer in 2-(2'-hydroxyphenyl)benzothiazole: a TDDFT molecular dynamics study.

Phys. Chem. Chem. Phys. 14(25) , 9016-25, (2012)

The dynamics of the excited-state proton transfer (ESPT) in a cluster of 2-(2'-hydroxyphenyl)benzothiazole (HBT) and hydrogen-bonded water molecules was investigated by means of quantum chemical simul...

A highly selective fluorescent probe for fast detection of hydrogen sulfide in aqueous solution and living cells.

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A new ratiometric fluorescence probe E1 based on an excited-state intramolecular proton transfer (ESIPT) mechanism for detection of hydrogen sulfide (H(2)S) is reported. E1 responds to H(2)S quickly a...

 Synonyms

2-(2-Benzothiazolyl)phenol
EINECS 222-299-9
Phenol, 2- (2-benzothiazolyl)-
2-(1,3-Benzothiazol-2-yl)phenol
2-(o-Hydroxyphenyl)benzothiazole
MFCD00022869
2-(Benzo[d]thiazol-2-yl)phenol
2-(benzo[d]thiazol-2-yl) phenol
2-(2-Hydroxyphenyl)benzothiazole
o-(2-Benzothiazolyl)phenol
Phenol, 2-(2-benzothiazolyl)-
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