(-)-Benzyl (R)-glycidyl ether

HCID 159746CAS 14618-80-5

기본 정보

표준 SMILES: c1ccc(COC[C@H]2CO2)cc1
InChIKey: QNYBOILAKBSWFG-JTQLQIEISA-N
분자식: C10H12O2
평균 분자량: 164.2 g/mol
단동위원소 질량: 164.08372962

이름 및 식별자

우선 이름: (-)-Benzyl (R)-glycidyl ether
IUPAC: (2R)-2-(phenylmethoxymethyl)oxirane
영어명: (R)-(-)-Benzyl glycidyl ether
분자식: C10H12O2
분자량: 164.2

이름 및 동의어

(-)-Benzyl (R)-glycidyl etherRefChem:390945Benzyl (-)-glycidyl ether604-513-614618-80-5(R)-2-((Benzyloxy)methyl)oxirane(R)-(-)-Benzyl glycidyl ether(r)-benzyloxymethyl-oxiraneBenzyl (R)-(-)-Glycidyl Ether(R)-Benzyl glycidyl ether(2R)-2-[(benzyloxy)methyl]oxiraneMFCD00068409

이름 더 보기

tert-butyl 3-oxoazepane-1-carboxylateazepan-3-onedicyclopropylmethanaminetert-butyl 4-hydroxyazepane-1-carboxylatebenzyl 3-hydroxypiperidine-1-carboxylatetert-butyl 3-hydroxyazepane-1-carboxylate2-(trimethylsilyl)ethanaminebenzyl piperidin-3-ylcarbamate(2R)-2-(Benzyloxymethyl)oxiranetert-butyl azepan-4-ylcarbamate

(R)-(-)-Glycidyl benzyl ether(R)-O-Benzylglycidol(2R)-2-(phenylmethoxymethyl)oxirane(R)-(-)-2-(Benzyloxymethyl)oxirane(R)-2-(benzyloxymethyl)oxirane(R)-benzylglycidyl etherOxirane, ((phenylmethoxy)methyl)-, (R)-DTXSID10932782

데이터베이스 식별자

CAS: 14618-80-5
PubChem CID: 159746
DTXSID: DTXSID10932782
EC Number: 604-513-6
Nikkaji: J82.509C

물성

구조 계산 물성

XLogP: 1.3
극성 표면적: 21.8 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 2
회전 가능 결합 수: 4
무거운 원자 수: 12
형식 전하: 0
복잡도: 130

물리화학적 성질

녹는점: 88 · 88-93°C
끓는 점: 130 °C · 130 °C (0.1 mmHg)
밀도: 1.077 g/mL · 1.077 g/mL at 25 °C(lit.)
굴절률: 20 · n20/D 1.517(lit.)
인화점: 230 °F · >230 °F
저장 조건: 2 · 2-8°C
물리적 상태: 페이스트(노란색)
Specific Gravity: 1.077 · 1.077
색상: 무색 내지 거의 무색
수용성: 물에 용해됩니다.
BRN: 3588399 · 3588399
InChI: InChI=1S/C10H12O2/c1-2-4-9(5-3-1)6-11-7-10-8-12-10/h1-5,10H,6-8H2/t10-/m0/s1
InChIKey: QNYBOILAKBSWFG-JTQLQIEISA-N
SMILES: O1C[C@@H]1COCC1=CC=CC=C1

화학적 성질

Colorless to light yellow liqui

안전 및 규제

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 4.2% (2 of 48) of reports.

Warning

H315 (95.8%): Causes skin irritation [Warning Skin corrosion/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)

Aggregated GHS information provided per 48 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesSkin Irrit. 2 (95.8%)

안전 데이터

wgk: 3
rtecs: TX2860020
ridadr: NA 1993 / PGIII
독성: mic-sat 660 nmol/plate MUREAV 298,197,1993
HS 번호: 29109000
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-36-37/39
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3
스토리지 클래스: 10 - Combustible liquids

화학 및 산업

응용 분야

용도Used in the preparation of the lactone fragment of compactin and mevinolin. Chiron in the preparation of syn-1,3-polyols, dideoxynucleosides, and a spiroacetal cyanohydrin.

일반 설명1H-Pyrazol-3-ylboronic acid hydrate can be used as a reactant in the Suzuki-Miyaura coupling reaction to synthesize pyrazole derivatives by reacting with different aryl halides over the palladium catalyst.