3-METHYL-4-NITRO-BUTYRALDEHYDE

Modify Date: 2025-09-19 18:51:01

3-METHYL-4-NITRO-BUTYRALDEHYDE structure	Common Name	3-METHYL-4-NITRO-BUTYRALDEHYDE
	CAS Number	50697-48-8	Molecular Weight	131.13000
	Density	N/A	Boiling Point	N/A
	Molecular Formula	C₅H₉NO₃	Melting Point	N/A
	MSDS	N/A	Flash Point	N/A

Name	3-methyl-4-nitrobutanal
Synonym	More Synonyms

Molecular Formula	C₅H₉NO₃
Molecular Weight	131.13000
Exact Mass	131.05800
PSA	62.89000
LogP	1.01140
InChIKey	BYOSZULJWYKCQL-UHFFFAOYSA-N
SMILES	CC(CC=O)C[N+](=O)[O-]

HS Code	2913000090

3-METHYL-4-NITR...

CAS#:2985-50-4

~97%

3-METHYL-4-NITR...

CAS#:50697-48-8

Literature: Yamashita, Dennis S.; Marquis, Robert W.; Xie, Ren; Nidamarthy, Sirishkumar D.; Oh, Hye-Ja; Jeong, Jae U.; Erhard, Karl F.; Ward, Keith W.; Roethke, Theresa J.; Smith, Brian R.; Cheng; Geng, Xiaoliu; Lin, Fan; Offen, Priscilla H.; Wang, Bing; Nevins, Neysa; Head, Martha S.; Haltiwanger, R. Curtis; Sarjeant, Amy A. Narducci; Liable-Sands, Louise M.; Zhao, Baoguang; Smith, Ward W.; Janson, Cheryl A.; Gao, Enoch; Tomaszek, Thaddeus; McQueney, Michael; James, Ian E.; Gress, Catherine J.; Zembryki, Denise L.; Lark, Michael W.; Veber, Daniel F. Journal of Medicinal Chemistry, 2006 , vol. 49, # 5 p. 1597 - 1612

Crotonaldehyde

CAS#:123-73-9

nitromethane

CAS#:75-52-5

~17%

3-METHYL-4-NITR...

CAS#:50697-48-8

Literature: Chen, Hauh-Jyun Candy; Applewhite, Terrence; Jayachandran; Kirk, Kenneth L. Journal of Fluorine Chemistry, 1998 , vol. 92, # 1 p. 41 - 44

nitromethane

CAS#:75-52-5

(E)-But-2-Enal

CAS#:15798-64-8

~20%

3-METHYL-4-NITR...

CAS#:50697-48-8

Literature: Parfenov, E. A.; Bekker, A. R.; Kostereva, G. F. Journal of Organic Chemistry USSR (English Translation), 1981 , p. 1412 - 1415 Zhurnal Organicheskoi Khimii, 1981 , vol. 17, # 8 p. 1591 - 1594

nitromethane

CAS#:75-52-5

Ethyl 2-butenoate

CAS#:10544-63-5

3-METHYL-4-NITR...

CAS#:50697-48-8

Literature: Marquis, Jr., Robert W.; Veber, Daniel F.; Yamashita, Dennis S. Patent: US2004/38965 A1, 2004 ; Location in patent: Page/Page column 16 ;

Precursor 5
CAS#:2985-50-4 3-METHYL-4-NITR... CAS#:123-73-9 Crotonaldehyde CAS#:75-52-5 nitromethane CAS#:15798-64-8 (E)-But-2-Enal
CAS#:10544-63-5 Ethyl 2-butenoate
DownStream 0

HS Code	2913000090
Summary	HS: 2913000090 halogenated, sulphonated, nitrated or nitrosated derivatives of products of heading 2912 Educational tariff:17.0% Tax rebate rate:9.0% Regulatory conditions:none Most favored nation tariff:5.5% General tariff:30.0%

3-METHYL-4-NITRO-BUTYRALDEHYDE

4-nitro-3-methylbutanal

Butanal,3-methyl-4-nitro

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3-METHYL-4-NITRO-BUTYRALDEHYDE

Names

Chemical & Physical Properties

Safety Information

Synthetic Route

Precursor & DownStream

Customs

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.