2-메톡시-2-페닐레탄올

Benzeneethanol, beta-methoxy-

HCID 102910CAS 2979-22-8
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
COC(CO)c1ccccc1
InChIKey
JDTUPLBMGDDPJS-UHFFFAOYSA-N
분자식
C9H12O2
평균 분자량
152.19 g/mol
단동위원소 질량
152.08372962

이름 및 식별자

우선 이름
Benzeneethanol, beta-methoxy-
IUPAC
2-methoxy-2-phenylethanol
현지명
2-메톡시-2-페닐레탄올
영어명
2-Methoxy-2-phenylethanol
분자식
C9H12O2
분자량
152.19

이름 및 동의어

2979-22-8Benzeneethanol, .beta.-methoxy-Benzeneethanol, beta-methoxy-EINECS 221-030-2DTXSID70863068RefChem:563236DTXCID508117442-methoxy-2-phenylethanol2-Methoxy-2-Phenylethan-1-Ol2-Methoxy-2-phenyl-ethanolbeta-Methoxyphenethyl alcoholMFCD00075063
이름 더 보기
2-메톡시-2-페닐레탄올2-Phenyl-2-methoxyethanolbeta-methoxy-benzeneethanoBenzeneethanol, β-methoxy-alpha-Methoxyphenethylalkohol.beta.-methoxy-Benzeneethanol2-Methoxy-2-phenylethanol 99%
(2R)-2-methoxy-2-phenylethanol2-Phenyl-2-methoxyethanol; beta-Methoxyphenethyl alcoholSCHEMBL872713SCHEMBL7265354OSM-S-3382-Methoxy-2-phenylethanol, 99%(+/-)-2-methoxy-2-phenylethanolAKOS015891276

데이터베이스 식별자

CAS
2979-22-8
PubChem CID
102910
DTXSID
DTXSID70863068
EC Number
221-030-2
Nikkaji
J28.526I

물성

구조 계산 물성

XLogP
0.9
극성 표면적
29.5 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
2
회전 가능 결합 수
3
무거운 원자 수
11

물리화학적 성질

끓는 점
237 °C · 237 °C (lit.)
밀도
1.061 g/mL · 1.061 g/mL at 25 °C (lit.)
굴절률
20 · n20/D 1.519(lit.)
인화점
208 °F · 208 °F
저장 조건
Sealed in dry,Room Temperature
산도 계수 (pKa)
14.18 · 14.18±0.10(Predicted)

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H302 (97.6%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, 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 41 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory InformationChemical: Benzeneethanol, .beta.-methoxy-
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Hazard Classes and CategoriesAcute Tox. 4 (97.6%)

안전 데이터

wgk
2
tsca
TSCA listed
HS 번호
2909498090
risk_code
20/21/22-36/37/38
hazard_code
Xn
safety_code
26-37/39

화학 및 산업

용도 및 제조

General Manufacturing InformationBenzeneethanol, .beta.-methoxy-: INACTIVE
응용 분야 · 1건

용도(S)-2-methoxy-2-phenylethanol was employed as chiral probe for the determination of absolute configuration of active (-) enantiomer of amlodipine. 2-Methoxy-2-phenylethanol was also used in the synthesis of optically active 1,4-dihydropyridines.

공급사34 곳

上海凌富药物研究有限公司+86(21)5895 0110 19945755304 · [email protected]
郑州鸿晟医药科技有限公司0371-55695890 15637198702 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
长沙麓兴生物科技有限公司0731-88827538 15574813303 · [email protected]

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