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Structure

Isopropylboronic acid

CAS
80041-89-0
Catalog Number
ACM80041890
Category
Other Products
Molecular Weight
87.91
Molecular Formula
C3H9BO2

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Specification

Synonyms
ISOPROPYLBORONIC ACID;2-PROPANEBORONIC ACID;RARECHEM AH PB 0254;PROPANE-2-BORONIC ACID;Isopropylboronicacid,98%;Isopropylboronic;(propan-2-yl)boronic acid;Isopropylboronic Acid (contains varying aMounts of Anhydride)
IUPAC Name
propan-2-ylboronic acid
Canonical SMILES
B(C(C)C)(O)O
InChI Key
QIPHSSYCQCBJAX-UHFFFAOYSA-N
Boiling Point
160.4ºC at 760 mmHg
Melting Point
95-100ºC
Flash Point
50.8ºC
Density
0.921 g/cm³
Appearance
white flakes
Exact Mass
88.06960
Hazard Statements
Xi:Irritant;
H-Bond Acceptor
2
H-Bond Donor
2
Safety Description
S26-S37/39
WGK Germany
3

Upstream Synthesis Route 1

  • 150-46-9
  • 1068-55-9
  • 80041-89-0

Reference: [1] Patent: US5736535, 1998, A,

Upstream Synthesis Route 2

  • 60-29-7
  • 150-46-9
  • 1068-55-9
  • 80041-89-0

Reference: [1] Patent: US6403561, 2002, B1,

Upstream Synthesis Route 3

  • 7732-18-5
  • 80041-89-0

Reference: [1] Journal of the American Chemical Society, 2012, vol. 134, # 17, p. 7431 - 7441

Upstream Synthesis Route 4

  • 688-74-4
  • 920-39-8
  • 80041-89-0

Reference: [1]Arkiv foer Kemi,1957,vol. 10,p. 171,172,175

Downstream Synthesis Route 1

  • 80041-89-0
  • 66740-05-4

Reference: [1]Journal of the American Chemical Society,1957,vol. 79,p. 5179

Downstream Synthesis Route 2

  • 80041-89-0
  • 513-86-0
  • 92304-40-0

Reference: [1]Journal of Organic Chemistry,1961,vol. 26,p. 4915 - 4917

* For details of the synthesis route, please refer to the original source to ensure accuracy.

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