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2,3-Dihydro-5-furylboronic acid pinacol ester

HCID 46739754
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
1046812-02-5
Standard SMILES
CC1(C)OB(C2=CCCO2)OC1(C)C
InChIKey
QLKFMGAHJYGUES-UHFFFAOYSA-N
Molecular formula
C10H17BO3
Average molar mass
196.05 g/mol
Monoisotopic mass
196.1270746

Names & identifiers

Preferred name
2,3-Dihydro-5-furylboronic acid pinacol ester
IUPAC
2-(2,3-dihydrofuran-5-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
English name
4,5-Dihydro-5-furylboronic acid pinacol ester, 2-(4,5-Dihydrofuran-2-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Molecular formula
C10H17BO3
Molecular weight
196.05

Names & synonyms

2,3-Dihydro-5-furylboronic acid pinacol esterRefChem:442349960-805-61046812-02-52-(4,5-Dihydrofuran-2-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolaneMFCD116560652-(2,3-dihydrofuran-5-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolaneDihydro-5-furylboronic acid pinacol esterSCHEMBL2013150DTXSID60675339QLKFMGAHJYGUES-UHFFFAOYSA-NAKOS015999416
Show more names
2-(4,5-Dihydrofuran-2-yl)4,5-Dihydrofuran-2-boronic Acid Pinacol Ester4,5-Dihydro-5-furylboronic acid pinacol ester2,3-Dihydro-5-furylboronic acid pinacol ester 97%1,3,2-Dioxaborolane, 2-(4,5-dihydro-2-furanyl)-4,4,5,5-tetramethyl-4,5-Dihydro-5-furylboronic acid pinacol ester, 2-(4,5-Dihydrofuran-2-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
AB64488AS-71992DA-15982FD159854SY046959CS-01008142,3-Dihydro-5-furanoboronic acid pinacol esterC90132

Properties

Computed structural properties

Topological polar surface area
27.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
14
Formal charge
0
Complexity
255

Physicochemical properties

Boiling point
218.8 · 218.8±50.0 °C(Predicted)
Density
1.018 g/mL · 1.018 g/mL at 25 °C
refractive index
20 · n20/D 1.467
Flash point
110 °C · 110 °C
storage temp.
2 · 2-8°C
form
liquid
Appearance
Light yellow to yellow Liquid
Stability
Moisture Sensitive
InChI
1S/C10H17BO3/c1-9(2)10(3,4)14-11(13-9)8-6-5-7-12-8/h6H,5,7H2,1-4H3
InChIKey
QLKFMGAHJYGUES-UHFFFAOYSA-N
SMILES
CC1(C)OB(OC1(C)C)C2=CCCO2
UNSPSC Code
12352103 · 12352103
NACRES
22 · NA.22
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 5 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Safety data

PPE
Eyeshields, Gloves, multi-purpose combination respirator cartridge (US)
wgk
3
hs_code
2934999090
Signal word
Warning
Symbol(GHS)
GHS07
Storage Class
10 - Combustible liquids
Hazard statements
H302-H315-H319-H335
Precautionary statements
P261-P305+P351+P338

Chemistry & industry

Applications

Uses2,3-Dihydro-5-furylboronic acid pinacol ester

Suppliers13 total

上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Aladdin Scientific[email protected]
韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]
上海贤鼎生物科技有限公司4009209199 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
广东翁江化学试剂有限公司0751-2815987 13927875076 · [email protected]
北京汇科盈生物科技有限公司15210661751 · [email protected]
上海昂提生物科技有限公司13764913901 · [email protected]
嘉兴市德亿化工有限公司86-0573-85866609 18367600069 · [email protected]
聿锦(天津)科技有限公司13370351217 kungfu1217@1 · [email protected]
BOC Sciences+1-631-485-4226 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
上海盛袖生物科技有限公司

Related reactions

2 records
New reaction record
HRID 335775 reaction equation
HRID 335775As reactantuspto-grants-2014_11
HRID 1970369 reaction equation
HRID 1970369As reactantuspto-grants-2013_04

Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes

Database identifiers

CAS
1046812-02-5
PubChem CID
46739754
DTXSID
DTXSID60675339
EC Number
960-805-6
Nikkaji
J2.588.635F
261 · P261-P305+P351+P338
PPE
Eyeshields, Gloves, multi-purpose combination respirator cartridge (US)
WGK Germany
3 · 3
HS Code
2934999090 · 2934999090
Storage Class
10 · 10 - Combustible liquids
13761144602 · [email protected]