1-(2H-1-Benzopyran-3-yl)ethanone

Modify Date: 2025-11-26 14:42:06

1-(2H-1-Benzopyran-3-yl)ethanone Structure
1-(2H-1-Benzopyran-3-yl)ethanone structure
Common Name 1-(2H-1-Benzopyran-3-yl)ethanone
CAS Number 51593-70-5 Molecular Weight 174.19600
Density 1.162g/cm3 Boiling Point 317.2ºC at 760 mmHg
Molecular Formula C11H10O2 Melting Point N/A
MSDS N/A Flash Point 151.1ºC

 Names

Name 1-(2H-chromen-3-yl)ethanone
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.162g/cm3
Boiling Point 317.2ºC at 760 mmHg
Molecular Formula C11H10O2
Molecular Weight 174.19600
Flash Point 151.1ºC
Exact Mass 174.06800
PSA 26.30000
LogP 2.05140
Index of Refraction 1.565
InChIKey SPWAIRGUACCVAD-UHFFFAOYSA-N
SMILES CC(=O)C1=Cc2ccccc2OC1

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DJ2110000
CHEMICAL NAME :
2H-1-Benzopyran, 3-acetyl-
CAS REGISTRY NUMBER :
51593-70-5
BEILSTEIN REFERENCE NO. :
1682021
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C11-H10-O2
MOLECULAR WEIGHT :
174.21
WISWESSER LINE NOTATION :
T66 BO CHJ DV1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
EJMCA5 European Journal of Medicinal Chemistry--Chimie Therapeutique. (Editions Scientifiques Elsevier, 29 rue Buffon, F-75005, Paris, France) V.9- 1974- Volume(issue)/page/year: 11,81,1976

 Safety Information

HS Code 2914190090

 Customs

HS Code 2914190090
Summary 2914190090 other acyclic ketones without other oxygen function。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:5.5%。General tariff:30.0%

 Synonyms

Ketone,2H-1-benzopyran-3-yl methyl
3-ACETYL-2H-CHROMENE
2H-1-BENZOPYRAN,3-ACETYL
2H-1-Benzopyran-3-yl methyl ketone
3-acetyl-2H-1-benzopyran
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