(2-Methoxynaphthalen-1-yl)boronic acid

HCID 4198751CAS 104116-17-8

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Basic information

Standard SMILES: COc1ccc2ccccc2c1B(O)O
InChIKey: NHVWTZOWDLOBBS-UHFFFAOYSA-N
Molecular formula: C11H11BO3
Average molar mass: 202.018 g/mol
Monoisotopic mass: 202.08012461

Names & identifiers

Preferred name: (2-Methoxynaphthalen-1-yl)boronic acid
IUPAC: (2-Methoxynaphthalen-1-yl)boronic acid
English name: (2-METHOXY-1-NAPHTHYL)BORONIC ACID
Molecular formula: C11H11BO3
Molecular weight: 202.01

Names & synonyms

(2-Methoxynaphthalen-1-yl)boronic acid21MONBA1-(2-Methoxynaphthyl)boronic acid2-Methoxynaphtalene-1-boronic acid(2-METHOXY-1-NAPHTHYL)BORONIC ACID(2-Methoxy-1-Naphthyl)bornoic acid2-METHOXY-1-NAPHTHALENEBORONIC ACID2-Methoxynaphthalene-1-boronic acid(2-Methoxynaphthalen-1-yl)boronicaciAcide (2-méthoxy-1-naphtyl)boronique

Database identifiers

CAS: 104116-17-8
PubChem CID: 4198751
DTXSID: DTXSID00400748
EC Number: 687-037-1
Nikkaji: J1.043.427K

Properties

Physicochemical properties

Melting point: 125 · 125-130°C
Boiling point: 425.2 · 425.2±47.0 °C(Predicted)
Density: 1.23 · 1.23±0.1 g/cm3(Predicted)
storage temp.: 2 · under inert gas (nitrogen or Argon) at 2-8°C
pka: 8.53 · 8.53±0.30(Predicted)
form: solid
color: White
InChI: InChI=1S/C11H11BO3/c1-15-10-7-6-8-4-2-3-5-9(8)11(10)12(13)14/h2-7,13-14H,1H3
InChIKey: NHVWTZOWDLOBBS-UHFFFAOYSA-N
SMILES: B(C1=C2C(C=CC=C2)=CC=C1OC)(O)O
UNSPSC Code: 12352103 · 12352103
NACRES: 22 · NA.22
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319-H335
Precautionary statements: 261 · P261-P305+P351+P338
target organs: Respiratory system
Hazard Codes: Xi
Risk Statements: 36 · 36/37/38
Safety Statements: 26 · 26
WGK Germany: 3 · 3
HS Code: 2931900090 · 2931900090
Storage Class: 11 · 11 - Combustible Solids
Hazard Classifications: 2 Skin · Eye Irrit. 2Skin Irrit. 2STOT SE 3

Safety & regulation

Safety data

wgk: 3
hs_code: 2931900090
risk_code: 36/37/38
Signal word: Warning
Symbol(GHS): GHS07
hazard_code: Xi
safety_code: 26
Storage Class: 11 - Combustible Solids
target organs: Respiratory system
Hazard statements: H315-H319-H335
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3
Precautionary statements: P261-P305+P351+P338

Chemistry & industry

Applications · 1 item

UsesReactant for:Design of phosphorus C,P-ligands for environmentally benign cross-coupling reactionsSterically hindered Suzuki-Miyaura couplingPalladium-catalyzed cross-coupling reactionsDeboronation homocoupling reactionsCopper-catalyzed N-arylation of imidazolesStereoselective preparation of biaryl compounds via palladium-catalyzed asymmetric Suzuki-Miyaura coupling

Upstream & downstream products

Upstream raw materials

Downstream products

10-bromobenzo[b]naphtho[1,2-d]furan

Suppliers50 total

阿诺西（上海）生物技术有限公司400-1107768 15058188853 · [email protected]

杭州鸿喜生物医药科技有限公司18989489206 · [email protected]

陕西缔都新材料有限公司81124267 17392282731 · [email protected]

BAYNOE CHEM CO.,LTD+86-21-34783353 +8615000719740 · [email protected]

合肥翰刚医药科技有限公司+8618062405514 · [email protected]

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