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3-Chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-amine

HCID 59619973
NotesReactions

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

Basic information

CAS
1032758-99-8
Standard SMILES
CC1(C)OB(c2cnc(N)c(Cl)c2)OC1(C)C
InChIKey
HDGMGELKCLHFIL-UHFFFAOYSA-N
Molecular formula
C11H16BClN2O2
Average molar mass
254.52 g/mol
Monoisotopic mass
254.0993356

Names & identifiers

Preferred name
3-Chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-amine
IUPAC
3-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-amine
English name
3-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-amine
Molecular formula
C11H16BClN2O2
Molecular weight
254.52

Names & synonyms

3-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-amine1032758-99-8MFCD129234053-CHLORO-5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-2-PYRIDINAMINESCHEMBL1180874DTXSID20732513HDGMGELKCLHFIL-UHFFFAOYSA-NAKOS016011795DS-7021MB121733-chloro-5-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-pyridin-2-ylamineSY244333
Show more names
2-Pyridinamine, 3-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
CS-0153870F20061F321020A1-025142-Amino-3-chloropyridine-5-boronic acid pinacol ester6-Amino-5-chloropyridine-3-boronic Acid Pinacol Ester

Database identifiers

CAS
1032758-99-8
PubChem CID
59619973
DTXSID
DTXSID20732513

Properties

Computed structural propertiesFilling in

Topological polar surface area
57.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
1
Heavy atoms
17
Formal charge
0
Complexity
285

Physicochemical properties

storage temp.
2 · 2-8°C(protect from light)
InChI
InChI=1S/C11H16BClN2O2/c1-10(2)11(3,4)17-12(16-10)7-5-8(13)9(14)15-6-7/h5-6H,1-4H3,(H2,14,15)
InChIKey
HDGMGELKCLHFIL-UHFFFAOYSA-N
SMILES
C1(N)=NC=C(B2OC(C)(C)C(C)(C)O2)C=C1Cl
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
261 · P261-P305+P351+P338

Safety & regulation

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

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P261-P305+P351+P338

Chemistry & industry

Upstream & downstream products

Upstream raw materials

2-AMINO-3-CHLORO-5-BROMOPYRIDINEBis(pinacolato)diboron[1,1'-Bis(diphenylphosphino)ferrocene]dichloropalladium(II)1,4-DioxanePotassium Acetate

Suppliers23 total

上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
安徽合诺生物科技有限公司0555-2761852
毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
浙江雅辰药物科技股份有限公司13674959855 13674959855 · [email protected]
安徽合诺生物科技有限公司18455579438
郑州药领医药科技有限公司13526569071 · [email protected]
苏州施亚生物科技有限公司86(512)5235 8471 17715136450 · [email protected]
上海安米克化学品有限公司微信 18019252918 18019252918 · [email protected]

Related reactions

10 records
New reaction record
HRID 296974 reaction equation
HRID 296974As reactantTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 391089 reaction equation
HRID 391089As reactantuspto-grants-2013_02
HRID 391090 reaction equation
HRID 391090As reactantuspto-grants-2013_02
HRID 445698 reaction equation
HRID 445698As reactantuspto-grants-2013_07
HRID 881508 reaction equation
HRID 881508As reactantuspto-grants-2015_03
HRID 881509 reaction equation
HRID 881509As reactantuspto-grants-2015_03
HRID 1365406 reaction equation
HRID 1365406As reactantuspto-grants-2011_02
HRID 1365407 reaction equation
HRID 1365407As reactantuspto-grants-2011_02
Page 1 of 2

Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
安耐吉化学&3A(安徽泽升科技股份有限公司)
400-0056266 · [email protected]
上海太氟医药科技有限公司13524951390 18930958102 · [email protected]
苏州施亚生物科技有限公司0512-0512-52358471 17715136450 · [email protected]
Guangzhou Yuheng Pharmaceutical Technology Co., Ltd+8613580539051 · [email protected]
四川铂友生物科技有限公司(原四川佰朋)028-65791793 18140026355 · [email protected]
江苏艾康生物医药研发有限公司025-58851090 13913916777 · [email protected]
上海康恩博医药科技有限公司(科小研试剂)400-1388-521 17510465506 · [email protected]
上海肯恩化学科技有限公司13701870891; 02152215958 · [email protected]
上海锋基医药科技有限公司15555063509 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 18917919676 · [email protected]
湖北省善乐兴生物科技有限公司18321145570 · [email protected]
苏州明石新科生物科技有限公司13914069417 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]