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2-Picoline-borane

2-Picoline-borane structure

CAS No:
3999-38-0
Formula:
C6H10BN
Chemical Name:
2-Picoline-borane
Synonyms:
Boron,trihydro(2-methylpyridine)-,(T-4)-;2-Picoline,compd. with borane (1:1);Pyridine,2-methyl-,compd. with borane (1:1);2-Picoline,compd. with BH3 (1:1);2-Picoline,compd. with BH3;Borane,compd. with 2-picoline (1:1);Borane,compd. with 2-methylpyridine (1:1);(T-4)-Trihydro(2-methylpyridine)boron;Pic-BH3;2-Picoline-borane;α-Picoline-borane adduct;(2-Methylpyridin-1-ium-1-yl)boranuide
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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2-Picoline-borane Basic Attributes

Molecular Weight：

106.96

Exact Mass：

107.090630

EC Number：

1312995-182-4

DSSTox ID：

DTXSID70462171

HScode：

29333990

Characteristics

PSA：

4.93000

XLogP3：

0.20610

Appearance：

White Solid

Density：

1.297 g/mL at 25 °C

Melting Point：

48 °C

Flash Point：

100°(212°F)

Water Solubility：

Slightly sol. in water, cyclohexane, very sol. in methanol, THF, diglyme, and benzene

Storage Conditions：

2-8°C

Safety Information

Packing level：

Hazard category：

4.3

Transport codes：

UN 3130 6.1(4.3) / PGII

wgk germany：

hazard class code：

14/15-40-36/37/38-26

safety instructions：

36/37-43-26-36/37/38-14/15

Marks：

F,Xn,Xi

Precautionary statement(s)：

P210, P231+P232, P240, P241, P260, P261, P264, P270, P271, P280, P284, P301+P310, P302+P352, P304+P340, P305+P351+P338, P310, P312, P320, P321, P322, P330, P332+P313, P337+P313, P361, P362, P363, P370+P378, P402+P404, P403+P233, P405, P501

Hazard Statements：

H228

GHS Classification：

|Danger|H228 (64.93%): Flammable solid [Danger Flammable solids]|P210, P231+P232, P240, P241, P260, P261, P264, P270, P271, P280, P284, P301+P310, P302+P352, P304+P340, P305+P351+P338, P310, P312, P320, P321, P322, P330, P332+P313, P337+P313, P361, P362, P363, P370+P378, P402+P404, P403+P233, P405, and P501|Aggregated GHS information provided by 134 companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

2-picoline borane

2-Picoline-borane Use and Manufacturing

Environmentally benign reducing agent. Reactant for: Reductive amination. N-Benzyl-protection of amino acid derivatives by reductive alkylation. Reductive alkoxyamination.

Computed Properties

Molecular Weight:103.94
Hydrogen Bond Acceptor Count:1
Exact Mass:104.0671544
Monoisotopic Mass:104.0671544
Topological Polar Surface Area:12.9
Heavy Atom Count:8
Complexity:52.1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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