CAS 85199-06-0 (2,5-Dimethylphenyl)boronic acid (HCID 2734347)

이름 및 식별자

우선 이름: (2,5-Dimethylphenyl)boronic acid
IUPAC: (2,5-dimethylphenyl)boronic acid
영어명: 2,5-Dimethylphenylboronic acid
분자식: C8H11BO2
분자량: 149.98

이름 및 동의어

(2,5-dimethylphenyl)boronic AcidRefChem:394646677-065-22,5-Dimethylphenylboronic acid85199-06-02,5-Dimethylbenzeneboronic AcidMFCD01863525Boronic acid, B-(2,5-dimethylphenyl)-2,5-Dimethylphenylboronicacidp-Xylene-2-boronic AcidBoronic acid, (2,5-dimethylphenyl)-(2,5-Dimethylphenyl)Boranediol

이름 더 보기

AKOS BRN-0066AKOS BRN-00862-Borono-p-xyleneCHEMBRDG-BB 4003297RARECHEM AH PB 0196RARECHEM AH PB 0089p-Xyleneboronic acid

B-(2,5-Dimethylphenyl)-Boronic Acid; 2,5-Xyleneboronic Acid; (2,5-Dimethylphenyl)-boronic Acid; (2,5-Dimethylphenyl)boronic Acid; p-Xyleneboronic Acid2,5-DIMETHYLBENZENEBORONICACID2,5-dimehylphenylboronic acidSCHEMBL5131362,5-Dimethylbenzenboronic acidorb29401242,5-dimethyl-phenylboronic acid2,5-dimethylphenyl boronic acid

데이터베이스 식별자

CAS: 85199-06-0
PubChem CID: 2734347
DTXSID: DTXSID80370238
EC Number: 677-065-2
Nikkaji: J1.762.499G

물성

구조 계산 물성

극성 표면적: 40.5 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 2
회전 가능 결합 수: 1
무거운 원자 수: 11
형식 전하: 0
복잡도: 127

물리화학적 성질

녹는점: 186 · 186-191 °C (lit.)
끓는 점: 305.1 · 305.1±52.0 °C(Predicted)
밀도: 1.07 · 1.07±0.1 g/cm3(Predicted)
저장 조건: Keep in dark place,Sealed in dry,Room Temperature
용해도: DMSO(약간 용해됨), 메탄올(약간 용해됨)
산도 계수 (pKa): 8.7 · 8.70±0.58(Predicted)
물리적 상태: 고체
색상: 하얀색
BRN: 3241785 · 3241785
InChI: 1S/C8H11BO2/c1-6-3-4-7(2)8(5-6)9(10)11/h3-5,10-11H,1-2H3
InChIKey: OOMZKLJLVGQZGV-UHFFFAOYSA-N
SMILES: Cc1ccc(C)c(c1)B(O)O

화학적 성질

white to light yellow crystal powde

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H302 (14.3%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (85.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 7 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 4 (14.3%)；Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (85.7%)

안전 데이터

wgk: 3
HS 번호: 29163990
risk_code: 36/37/38-22
hazard_code: Xn,Xi
safety_code: 37/39-26-36/37
위험 등급: IRRITANT
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

응용 분야

용도Reactant for:• ;Friedel-Crafts alkylation1• ;Suzuki-Miyaura coupling2

상·하류 제품 정보

상류 원료

하류 제품

2,2',5,5'-테트라메틸비페닐

공급사100 곳

北京华美互利生物化工010-56205725 · [email protected]

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

郑州阿尔法化工有限公司+86-18530059196 · [email protected]

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

T&W GROUP021-61551611 13296011611 · [email protected]

화합물 노트

불러오는 중…

(2,5-Dimethylphenyl)boronic acid

기본 정보