Methyl (2R,3S)-3-(4-methoxyphenyl)-2-oxiranecarboxylate

HCID 158607
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기본 정보

CAS
105560-93-8
표준 SMILES
COC(=O)[C@@H]1O[C@H]1c1ccc(OC)cc1
InChIKey
CVZUMGUZDAWOGA-VHSXEESVSA-N
분자식
C11H12O4
평균 분자량
208.21 g/mol
단동위원소 질량
208.07355886

이름 및 식별자

우선 이름
Methyl (2R,3S)-3-(4-methoxyphenyl)-2-oxiranecarboxylate
IUPAC
methyl (2R,3S)-3-(4-methoxyphenyl)oxirane-2-carboxylate
영어명
Methyl (2R,3S)-2,3-epoxy-3-(4-methoxyphenyl)propionate
분자식
C11H12O4
분자량
208.21

이름 및 동의어

RefChem:812083Methyl (2R,3S)-3-(4-methoxyphenyl)-2-oxiranecarboxylate105560-93-8methyl (2R,3S)-3-(4-methoxyphenyl)oxirane-2-carboxylateMETHYL (2R,3S)-2,3-EPOXY-3-(4-METHOXYPHENYL)PROPIONATED8MQ7L5PJ2Methyl 2,3-epoxy-3-(4-methoxyphenyl)propionate, (2R,3S)-(-)-96125-49-4(2R,3S)-methyl 3-(4-methoxyphenyl)oxirane-2-carboxylateMethyl (2R,3S)-2,3-epoxy-3-(4-methoxyphenyl)propronate84056-02-0UNII-D8MQ7L5PJ2
이름 더 보기
METHYL (2R,3S)-2,3-ETicagrelor Impurity 241(S)-(-)-1,1''-BI-2-NAPHTHOL 99 E.E+%methyl (2R,3S)-3-(4-methoxyphenyl)glycidate*Halothane Impurity 3 (Halothane EP Impurity C)(-)-(2R,3S)-2,3-Epoxy-3-(4methoxyphenyl)propronate(-)-(2R,3S)-2,2-Epoxy-3-(4-methoxyphenyl)propionate(2R,3S)-3-(4-Methoxyphenyl)glycidic acid methyl ester
Methyl 2R,3S-(-)-3-(4-methoxyphenyl)oxiranecarboxylatemethyl (2S,3S)-3-(4-methoxyphenyl)oxirane-2-carboxylateSCHEMBL3201279Oxiranecarboxylic acid, 3-(4-methoxyphenyl)-, methyl ester, (2R,3S)-rel-CVZUMGUZDAWOGA-VHSXEESVSA-DTXSID701365294AKOS015904393AC-22558

데이터베이스 식별자

CAS
105560-93-8、84056-02-0
PubChem CID
158607
DTXSID
DTXSID701365294
UNII
D8MQ7L5PJ2
EC Number
404-130-2
Nikkaji
J547.196F

물성

구조 계산 물성

XLogP
1.3
극성 표면적
48.1 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
4
회전 가능 결합 수
4
무거운 원자 수
15

물리화학적 성질

녹는점
87 · 87-88 °C
끓는 점
297.7 · 297.7±40.0 °C(Predicted)
밀도
1.224 · 1.224

안전 및 규제

GHS 분류

GHS Classification · 6건

Danger

H317: May cause an allergic skin reaction [Warning Sensitization, Skin]

P261, P264+P265, P272, P273, P280, P302+P352, P305+P354+P338, P317, P321, P333+P317, P362+P364, and P501 (click each P-code to see the statement)

Danger

H317: May cause an allergic skin reaction [Warning Sensitization, Skin]

P261, P264+P265, P272, P273, P280, P302+P352, P305+P354+P338, P317, P321, P333+P317, P362+P364, and P501 (click each P-code to see the statement)

유해성 정보

Regulatory InformationStatus: Active Update: 10-11-2008 https://echa.europa.eu/registration-dossier/-/registered-dossier/4299
Hazard Classes and Categories · 2건

Eye damage - category 1

Eye Dam. 1

안전 데이터

risk_code
41-43-52/53
hazard_code
Xi
safety_code
24-26-37/39-61

화학 및 산업

응용 분야

용도Methyl (-)-(2R,3S)-2,3-epoxy-3-(4methoxyphenyl)propronate is a chiral intermediate and is prepared using newly isolated Galactomyces geotrichum.

상·하류 제품 정보

공급사35 곳

湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海康意福化学有限公司+86-576-88883591, 13255869379 · [email protected]
淄博容纳生物科技有限公司+86-86-13583358881 +8618560316533 · [email protected]

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