D-Camphorsulfonic Acid
기본 정보
- CAS
2287183-06-4- 표준 SMILES
CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)O)C(=O)C2- InChIKey
MIOPJNTWMNEORI-GMSGAONNSA-N- 분자식
- C10H16O4S
- 평균 분자량
- 232.3 g/mol
개요
(S)-camphorsulfonic acid is the S enantiomer of camphorsulfonic acid. It is a conjugate acid of a (S)-camphorsulfonate. It is an enantiomer of a (R)-camphorsulfonic acid.
이름 및 식별자
- 우선 이름
- D-Camphorsulfonic Acid
- IUPAC
- [(1S,4R)-7,7-dimethyl-2-oxo-1-bicyclo[2.2.1]heptanyl]methanesulfonic acid
- 영어명
- Voriconazole EP IMpurity E
- 분자식
- C10H16O4S
- 분자량
- 232.3
이름 및 동의어
Reychler's acidd-Camphorsulfonic acidCamphersulfosaeured-camphor sulfonic acidCamphorsulfonic acid, d-Camphersulfosaeure [German]9TLZ01S15L2-Oxobornane-10-sulphonic acidDL-6-Oxobornane-10-sulphonic acidEINECS 221-554-1D8D049375QAI3-23953
이름 더 보기
VoricozoleEPImpurityEVoriconazole EP IMpurity EBicyclo[2.2.1]heptane-1-methanesulfonic acid, 7,7-dimethyl-2-oxo-, (1R,4S)-rel-
D-CAMPHORSULFONIC ACID [MI]CAMPHORSULFONIC ACID, (+)-CAMPHORSULFONIC ACID [WHO-DD]D-CAMPHOR SULFONIC ACID [USP-RS]VORICONAZOLE IMPURITY E [EP IMPURITY]Bicyclo(2.2.1)heptane-1-methanesulfonic acid, 7,7-dimethyl-2-oxo-CamphostylBicyclo[2.2.1]heptane-1-methanesulfonic acid, 7,7-dimethyl-2-oxo-, (1S,4R)-
데이터베이스 식별자
- CAS
2287183-06-4- ChEBI
CHEBI:55403- UNII
- 9TLZ01S15L、D8D049375Q
- EC Number
- 221-554-1、227-527-0
- Nikkaji
- J9.522B
물성
구조 계산 물성
- XLogP
- 0.5
- 극성 표면적
- 79.8 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 15
- 형식 전하
- 0
- 복잡도
- 404
실험 및 물리화학적 성질
Chemical ClassesOther Classes -> Organic Acids
SpringerMaterials PropertiesDiamagnetic susceptibility
Vapor Pressure0.00000007 [mmHg]
Physical DescriptionSolid; Deliquescent in moist air; [Merck Index] White hygroscopic powder; [Alfa Aesar MSDS]
물리화학적 성질
- 밀도
- 1.331 · 1.331±0.06 g/cm3(Predicted)
- 산도 계수 (pKa)
- 1.17 · 1.17±0.50(Predicted)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Danger
H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 70 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
This chemical does not meet GHS hazard criteria for 14.3% (8 of 56) of reports.
Danger
유해성 정보
Regulatory Information
Status: Active Update: 21-12-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/19527
Status: Active Update: 18-10-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/17113
Bicyclo2.2.1heptane-1-methanesulfonic acid, 7,7-dimethyl-2-oxo-: Does not have an individual approval but may be used under an appropriate group standard
(1S)-(+)-Camphor-10-sulphonic acid: Does not have an individual approval but may be used under an appropriate group standard
Hazards SummarySubcutaneous LD50 (mouse) = 2,502 mg/kg; [RTECS] Causes burns; Inhalation may cause corrosive injuries to upper respiratory tract and lungs; [Alfa Aesar MSDS]
Hazard Classes and Categories
Skin Corr. 1B (100%)
Skin Corr. 1B (85.7%)
독성 정보
Adverse EffectsDermatotoxin - Skin burns.
화학 및 산업
용도 및 제조
UsesUsed for the resolution of optically active isomers; [Merck Index]
General Manufacturing Information
Bicyclo[2.2.1]heptane-1-methanesulfonic acid, 7,7-dimethyl-2-oxo-, (1S,4R)-: ACTIVE
Bicyclo[2.2.1]heptane-1-methanesulfonic acid, 7,7-dimethyl-2-oxo-: ACTIVE
관련 반응
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