Benzene,1-bromo-3-(difluoromethyl)-

CAS

29848-59-7

Catalog Number

ACM29848597

Category

Other Products

Molecular Weight

207.02

Molecular Formula

C₇H₅BrF₂

MSDS COA Spec Sheet

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Specification

Synonyms

1-bromo-3-(difluoromethyl)benzene, 29848-59-7, AC1MCHCT, SureCN248466, 3-difluoromethyl bromobenzene, 1-bromo-3-difluoromethylbenzene, CTK4G3907, MolPort-000-160-148, 3-DIFLUOROMETHYLBROMOBENZENE, ANW-49564, Benzene,1-bromo-3-(difluoromethyl)-, AKOS005256047, AG-C-20226, AG-L-22832, PC50007, RP26282, AK-50673, BR-50673, KB-31541, 1-[bis(fluoranyl)methyl]-3-bromanyl-benzene

IUPAC Name

1-bromo-3-(difluoromethyl)benzene

Canonical SMILES

C1=CC(=CC(=C1)Br)C(F)F

InChI Key

UJHIUQWUSQZMOL-UHFFFAOYSA-N

Boiling Point

197.7ºC at 760 mmHg

Flash Point

73.4ºC

Density

1.549 g/cm³

Exact Mass

205.95400

H-Bond Acceptor

H-Bond Donor

Upstream Synthesis Route 1

3132-99-8

29848-59-7

Reference: [1] Synlett, 2016, vol. 27, # 1, p. 25 - 28
[2] Patent: WO2015/171610, 2015, A2, . Location in patent: Paragraph 000525
[3] Journal of the American Chemical Society, 1971, vol. 93, # 19, p. 4715 - 4724
[4] Patent: US6344558, 2002, B1, . Location in patent: Example 9
[5] Patent: WO2018/115380, 2018, A1, . Location in patent: Page/Page column 96

Upstream Synthesis Route 2

3429-52-5
591-18-4

29848-59-7

Reference: [1] Organometallics, 2017, vol. 36, # 7, p. 1220 - 1223

Upstream Synthesis Route 3

403-25-8

29848-59-7

Reference: [1] Journal of Organic Chemistry USSR (English Translation), 1970, vol. 6, p. 1436 - 1439[2] Zhurnal Organicheskoi Khimii, 1970, vol. 6, # 7, p. 1423 - 1426

Upstream Synthesis Route 4

3132-99-8

29848-59-7

Reference: [1]Synlett,2016,vol. 27,p. 25 - 28
[2]Patent: WO2015/171610,2015,A2 .Location in patent: Paragraph 000525
[3]Journal of the American Chemical Society,1971,vol. 93,p. 4715 - 4724
[4]Patent: US6344558,2002,B1 .Location in patent: Example 9
[5]Patent: WO2018/115380,2018,A1 .Location in patent: Page/Page column 96

Upstream Synthesis Route 5

368-99-0

29848-59-7

Reference: [1]Journal of Organic Chemistry USSR (English Translation),1970,vol. 6,p. 1436 - 1439
Zhurnal Organicheskoi Khimii,1970,vol. 6,p. 1423 - 1426

Upstream Synthesis Route 6

403-25-8

29848-59-7

Reference: [1]Journal of Organic Chemistry USSR (English Translation),1970,vol. 6,p. 1436 - 1439
Zhurnal Organicheskoi Khimii,1970,vol. 6,p. 1423 - 1426

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