DL-만델산
Mandelic Acid
데이터를 보충하는 중입니다. 잠시 후 페이지를 새로 고치면 최신 내용을 볼 수 있습니다
기본 정보
- CAS
611-72-3- 표준 SMILES
O=C(O)C(O)c1ccccc1- InChIKey
IWYDHOAUDWTVEP-UHFFFAOYSA-N- 분자식
- C8H8O3
- 평균 분자량
- 152.15 g/mol
- 단동위원소 질량
- 152.04734411
개요
Mandelic acid is a 2-hydroxy monocarboxylic acid that is acetic acid in which two of the methyl hydrogens are substituted by phenyl and hydroxyl groups. It has a role as an antibacterial agent and a human xenobiotic metabolite. It is a member of benzenes and a 2-hydroxy monocarboxylic acid. It is functionally related to an acetic acid. It is a conjugate acid of a mandelate.
이름 및 식별자
- 우선 이름
- Mandelic Acid
- IUPAC
- 2-hydroxy-2-phenylacetic acid
- 현지명
- DL-만델산
- 영어명
- DL-Mandelic acid
- 분자식
- C8H8O3
- 분자량
- 152.15
이름 및 동의어
MANDELIC ACIDdl-Mandelic acid2-hydroxy-2-phenylacetic acid90-64-2Phenylglycolic acidParamandelic acidAmygdalic acidUromalineRacemic mandelic acidPhenylhydroxyacetic acid(RS)-Mandelic acidAcido mandelico
이름 더 보기
DL-만델산DL-만델산(DL-MANDELICACID)DL-MandelicaciDL-MANDELSAEURE SDL-AMYGDALIC ACIDMANDELIC ACID, DL-RARECHEM AL BO 1098TIMTEC-BB SBB007730(R)(S)-MANDELICACIDMANDELIC(D,L-) ACID
Kyselina mandlovaBenzeneacetic acid, alpha-hydroxy-alpha-Hydroxybenzeneacetic acidNSC-7925alpha-Hydroxyphenylacetic acidNH496X0UJXDTXSID6023234CHEBI:35825
데이터베이스 식별자
- CAS
611-72-3、90-64-2- PubChem CID
- 1292
- DTXSID
DTXSID6023234- ChEMBL
CHEMBL1609- ChEBI
CHEBI:35825- UNII
- NH496X0UJX
- EC Number
- 202-007-6、210-277-1
- Nikkaji
- J2.433.033H、J2.433.034F、J3.918G
물성
구조 계산 물성보충 중
- XLogP
- 0.6
- 극성 표면적
- 57.5 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 11
- 형식 전하
- 0
- 복잡도
- 138
실험 및 물리화학적 성질
Chemical ClassesOther Classes -> Organic Acids
CosmeticsAntimicrobial
LogP0.64
Density
1.3 @25 °C
1.3 @25 °C
Boiling Point320 °C @760 [mm Hg]
Melting Point119 °C
Vapor Pressure0.0000164 [mmHg]
Physical Description
Liquid
Solid; Darkens and decomposes after prolonged light exposure; [Merck Index] White crystalline powder with a faint sweet odor; [Fisher Scientific MSDS]
물리화학적 성질
- 녹는점
- 119 · 119-121 °C(lit.)
- 끓는 점
- 234.6 °C · 234.6°C (rough estimate)
- 밀도
- 1.289 · 1.2890
- 굴절률
- 1.4945 · 1.4945 (estimate)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 25.3% (66 of 261) of reports.
Danger
H302 (23.4%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 261 reports by companies from 11 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
This chemical does not meet GHS hazard criteria for 1.8% (2 of 111) of reports.
유해성 정보
Regulatory Information
Chemical: Benzeneacetic acid, .alpha.-hydroxy-
Benzeneacetic acid, .alpha.-hydroxy- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Benzeneacetic acid, .alpha.-hydroxy- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
REACH registered substance: Mandelic acid (EC: 202-007-6)
Benzeneacetic acid, .alpha.-hydroxy-: Does not have an individual approval but may be used under an appropriate group standard
Other Safety InformationIMAP assessments - Benzeneacetic acid, .alpha.-hydroxy-: Human health tier I assessment
Hazards SummaryCauses gastritis and other liver changes in oral lethal-dose studies of rabbits; [RTECS] An irritant; Chronic exposure may cause kidney injury and digestive tract abnormalities; [Fisher Scientific MSDS]
Hazard Classes and Categories
Acute Tox. 4 (50.5%)
Acute Tox. 4 (23.4%)
안전 및 보호
화학 및 산업
약리 정보
ATC Code
J - Antiinfectives for systemic use
B - Blood and blood forming organs
QB - Blood and blood forming organs
QJ - Antiinfectives for systemic use
용도 및 제조
UsesUsed as a urinary antiseptic; [Merck Index]
U.S. Production2023: 75,000 - <500,000 lb
Industry UsesIntermediate
Use ClassificationCosmetics -> Antimicrobial
General Manufacturing Information
All Other Chemical Product and Preparation Manufacturing
Benzeneacetic acid, .alpha.-hydroxy-: ACTIVE
응용 분야
개요DL-Mandelic acid is a chemical compound belonging to the family of alpha hydroxy acids (AHAs). It is a racemic mixture containing equal amounts of the D and L enantiomers of Mandelic acid. It is commonly used in skincare products for its exfoliating and antibacterial properties. DL-Mandelic Acid is useful in suppressing pigmentation, treating inflammatory non-cystic acne, and rejuvenating photoaged skin. Moreover, it has proven useful in preparing the skin for laser peeling and helping the skin heal after laser surgery. This product appears as a white crystal substance.
상·하류 제품 정보
상류 원료
관련 반응
94건
화합물 노트
불러오는 중…