UNII:4TR9Q57OTG

Modify Date: 2024-01-03 18:21:13

UNII:4TR9Q57OTG Structure
UNII:4TR9Q57OTG structure
Common Name UNII:4TR9Q57OTG
CAS Number 127-66-2 Molecular Weight 146.186
Density 1.1±0.1 g/cm3 Boiling Point 217.5±0.0 °C at 760 mmHg
Molecular Formula C10H10O Melting Point 48-52 °C
MSDS N/A Flash Point 96.1±0.0 °C

 Names

Name (±)-2-Phenyl-3-butyn-2-ol
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.1±0.1 g/cm3
Boiling Point 217.5±0.0 °C at 760 mmHg
Melting Point 48-52 °C
Molecular Formula C10H10O
Molecular Weight 146.186
Flash Point 96.1±0.0 °C
Exact Mass 146.073166
PSA 20.23000
LogP 1.80
Vapour Pressure 0.1±0.4 mmHg at 25°C
Index of Refraction 1.554
Storage condition 2-8°C

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
ES0840000
CHEMICAL NAME :
3-Butyn-2-ol, 2-phenyl-
CAS REGISTRY NUMBER :
127-66-2
BEILSTEIN REFERENCE NO. :
1100096
LAST UPDATED :
199701
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C10-H10-O
MOLECULAR WEIGHT :
146.20
WISWESSER LINE NOTATION :
QX1&R&1UU1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
620 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 4,477,1954

 Safety Information

Hazard Codes Xn:Harmful;
Risk Phrases R22
Safety Phrases S22-S24/25
WGK Germany 3
RTECS ES0840000
HS Code 2906299090

 Synthetic Route

 Customs

HS Code 2906299090
Summary 2906299090 other aromatic alcohols。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:5.5%。General tariff:30.0%

 Synonyms

UNII:4TR9Q57OTG
α-Ethynyl-α-methylbenzenemethanol
2-Phenyl-3-butyn-2-ol
2-phenylbut-3-yn-2-ol
Benzenemethanol, α-ethynyl-α-methyl-
3-Hydroxy-3-phenyl-1-butyne
EINECS 204-855-2
Benzyl alcohol, α-ethynyl-α-methyl-
MFCD00004454
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