Name: Name:Methyl 4-bromocrotonate, tech grade
Brand: AABLOCKS
SKU: AA00390G
Rating: 90 (10 reviews)

Technical Information

Catalog Number: AA00390G

Chemical Name: Methyl 4-bromocrotonate, tech grade

CAS Number: 1117-71-1

Molecular Formula: C5H7BrO2

Molecular Weight: 179.0119

MDL Number: MFCD00000246

SMILES: COC(=O)/C=C/CBr

NSC Number: 77073

Properties

Complexity: 98.6

Covalently-Bonded Unit Count: 1

Defined Bond Stereocenter Count: 1

Heavy Atom Count: 8

Hydrogen Bond Acceptor Count: 2

Rotatable Bond Count: 3

XLogP3: 1.1

Upstream Synthesis Route

1117-71-1

13991-36-1

[1]Patent:CN105669521,2016,A,.Locationinpatent:Paragraph0104;0105;0106

[2]Patent:CN106946896,2017,A,.Locationinpatent:Paragraph0054

[3]TetrahedronLetters,1991,vol.32,#34,p.4239-4242

[4]Tetrahedron,1993,vol.49,#18,p.3691-3734

[5]JournalofOrganicChemistry,1994,vol.59,#24,p.7259-7266

[6]TetrahedronLetters,1991,vol.32,#34,p.4239-4242

[7]Patent:CN103987700,2016,B,.Locationinpatent:Paragraph0164-0166

[8]Patent:WO2010/104406,2010,A1,.Locationinpatent:Page/Pagecolumn77

[9]JournaloftheChemicalSociety,1949,p.3104

[10]JustusLiebigsAnnalenderChemie,1942,vol.551,p.115

[11]JournalofMedicinalChemistry,2001,vol.44,#17,p.2719-2734

[12]Patent:EP1950201,2008,A1,.Locationinpatent:Page/Pagecolumn58

[13]Patent:EP1117659,2003,B1,.Locationinpatent:Page54

[14]Patent:EP1171440,2004,B1,.Locationinpatent:Page45

[15]Patent:US2005/250761,2005,A1,.Locationinpatent:Page/Pagecolumn13-14

1117-71-1

10035-10-6

13991-36-1

[1]JustusLiebigsAnnalenderChemie,1942,vol.551,p.115

67-56-1

13991-36-1

1117-71-1

[1]Patent:CN107556289,2018,A,.Locationinpatent:Paragraph0112;0117;0118;0119

[2]TetrahedronAsymmetry,2009,vol.20,#10,p.1164-1167

623-43-8

1117-71-1

[1]JournaloftheChemicalSociety-PerkinTransactions1,1997,#11,p.1629-1632

[2]Tetrahedron,1988,vol.44,#9,p.2541-2548

[3]Phytochemistry(Elsevier),1983,vol.22,#4,p.1028-1030

[4]AngewandteChemie-InternationalEdition,2007,vol.46,#7,p.1066-1070

[5]JournaloftheIndianChemicalSociety,2002,vol.79,#11,p.876-883

[6]AustralianJournalofChemistry,1978,vol.31,p.863-891

[7]TetrahedronLetters,1989,vol.30,#52,p.7399-7402

[8]JournaloftheChemicalSociety,PerkinTransactions1:OrganicandBio-OrganicChemistry(1972-1999),1983,#12,p.2921-2926

[9]RevueRoumainedeChimie,2002,vol.47,#6,p.543-544

[10]Patent:US4886817,1989,A,

[11]Patent:CN106146511,2016,A,.Locationinpatent:Paragraph0249;0250;0251

623-43-8

1117-71-1

[1]JournalofOrganicChemistry,1986,vol.51,#26,p.5243-5252

[2]JustusLiebigsAnnalenderChemie,1942,vol.551,p.115

[3]ChemischeBerichte,1948,vol.81,p.368,371

[4]JustusLiebigsAnnalenderChemie,1942,vol.551,p.115

[5]ChemischeBerichte,1948,vol.81,p.368,371

[6]JournaloftheChemicalSociety,1949,p.3104

[7]HelveticaChimicaActa,1946,vol.29,p.573,580

Downstream Synthesis Route

1117-71-1

51015-29-3

94001-77-1

[1]JournaloftheChemicalSociety.PerkintransactionsI,1970,vol.9,p.1266-1271

[2]JournaloftheChemicalSociety.PerkintransactionsI,1970,vol.9,p.1266-1271

1117-71-1

881-57-2

100976-73-6

[1]ChemischeBerichte,1957,vol.90,p.1512,1517

1117-71-1

7500-91-6

4-(1-hydroxy-2-methoxycarbonyl-2-methyl-cyclohexyl)-crotonicacidmethylester

[1]Bachmann;Dreiding[JournalofOrganicChemistry,1948,vol.13,p.317,319]

1117-71-1

51015-29-3

94571-17-2

[1]JournaloftheIndianChemicalSociety,1963,vol.40,p.327-338

67-56-1

1117-71-1

tetracarbonylnickel

5164-76-1

4756-84-7

[1]Tetrahedron,1992,vol.48,p.3147-3162

1117-71-1 | Methyl 4-bromocrotonate, tech grade