34DIMETHOXY2METHYLBUTYROPHENONE

Modify Date: 2024-01-20 21:09:33

34DIMETHOXY2METHYLBUTYROPHENONE structure	Common Name	34DIMETHOXY2METHYLBUTYROPHENONE
	CAS Number	67049-70-1	Molecular Weight	222.28000
	Density	1.015g/cm3	Boiling Point	320.7ºC at 760 mmHg
	Molecular Formula	C₁₃H₁₈O₃	Melting Point	N/A
	MSDS	N/A	Flash Point	138.8ºC

Name	1-(3,4-Dimethoxyphenyl)-2-methyl-1-butanone
Synonym	More Synonyms

Density	1.015g/cm3
Boiling Point	320.7ºC at 760 mmHg
Molecular Formula	C₁₃H₁₈O₃
Molecular Weight	222.28000
Flash Point	138.8ºC
Exact Mass	222.12600
PSA	35.53000
LogP	2.93260
Index of Refraction	1.491
InChIKey	UFWKGXSNLSLTRI-UHFFFAOYSA-N
SMILES	CCC(C)C(=O)c1ccc(OC)c(OC)c1

CHEMICAL IDENTIFICATION

RTECS NUMBER :: EU2335000

CHEMICAL NAME :: Butyrophenone, 3',4'-dimethoxy-2-methyl-

CAS REGISTRY NUMBER :: 67049-70-1

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C13-H18-O3

MOLECULAR WEIGHT :: 222.31

WISWESSER LINE NOTATION :: 2Y1&VR CO1 DO1

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 :: 530 mg/kg

TOXIC EFFECTS :: Behavioral - altered sleep time (including change in righting reflex)

REFERENCE :: JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 7,178,1964

sec-Butyllithiu...

CAS#:598-30-1

Veratric acid

CAS#:93-07-2

~21%

34DIMETHOXY2MET...

CAS#:67049-70-1

Literature: Chau, Nguyet Trang Thanh; Nguyen, Thi Huu; Castanet, Anne-Sophie; Nguyen, Kim Phi Phung; Mortier, Jacques Tetrahedron, 2008 , vol. 64, # 46 p. 10552 - 10557

1,2-Dimethoxybenzene

CAS#:91-16-7

Butanoyl chlori...

CAS#:5856-79-1

34DIMETHOXY2MET...

CAS#:67049-70-1

Literature: Moffett,R.B. et al. Journal of Medicinal Chemistry, 1964 , vol. 7, p. 178 - 186

2-Methylbutyric acid

CAS#:116-53-0

1,2-Dimethoxybenzene

CAS#:91-16-7

34DIMETHOXY2MET...

CAS#:67049-70-1

Literature: Kraft, Philip; Eichenberger, Walter European Journal of Organic Chemistry, 2003 , # 19 p. 3735 - 3743

sec-Butyllithiu...

CAS#:598-30-1

Veratric acid

CAS#:93-07-2

methyl iodide

CAS#:74-88-4

~22%

4,5-Dimethoxy-2...

CAS#:20736-28-1

Detail

Literature: Chau, Nguyet Trang Thanh; Nguyen, Thi Huu; Castanet, Anne-Sophie; Nguyen, Kim Phi Phung; Mortier, Jacques Tetrahedron, 2008 , vol. 64, # 46 p. 10552 - 10557

Precursor 6
CAS#:598-30-1 sec-Butyllithiu... CAS#:93-07-2 Veratric acid CAS#:91-16-7 1,2-Dimethoxybenzene CAS#:5856-79-1 Butanoyl chlori...
CAS#:116-53-0 2-Methylbutyric acid CAS#:74-88-4 methyl iodide
DownStream 1
CAS#:67049-69-8 34DIHYDROXY2MET...

3,4-dimethoxy-2-hydroxybenzaldehyde oxime

Benzaldehyde,2-hydroxy-3,4-dimethoxy-,oxime

3',4'-Dimethoxy-2-methyl-butyrophenon

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34DIMETHOXY2METHYLBUTYROPHENONE

Names

Chemical & Physical Properties

Toxicological Information

CHEMICAL IDENTIFICATION

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

Synthetic Route

Precursor & DownStream

Synonyms

The content on this webpage is sourced from various professional data sources. If you have any questions or concerns regarding the content, please feel free to contact service1@chemsrc.com.