15-히드록시펜타데칸산

15-Hydroxypentadecanoic acid

HCID 78360CAS 4617-33-8

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: O=C(O)CCCCCCCCCCCCCCO
InChIKey: BZUNJUAMQZRJIP-UHFFFAOYSA-N
분자식: C15H30O3
평균 분자량: 258.4 g/mol
단동위원소 질량: 258.21949481

이름 및 식별자

우선 이름: 15-Hydroxypentadecanoic acid
IUPAC: 15-hydroxypentadecanoic acid
현지명: 15-히드록시펜타데칸산
영어명: 15-Hydroxypentadecanoic acid
분자식: C15H30O3
분자량: 258.4

이름 및 동의어

15-Hydroxypentadecanoic acid4617-33-8Pentadecanoic acid, 15-hydroxy-FU65P3692TEINECS 225-026-1CHEBI:79169DTXSID0019675015-HYDROXY PENTADECANOIC ACID.OMEGA.-HYDROXYPENTADECANOIC ACID14-HYDROXY-1-TETRADECANECARBOXYLIC ACIDRefChem:437485DTXCID40119241

이름 더 보기

15-히드록시펜타데칸산15-HydroxytenateOMEGA-HYDROXY C15:015 hydroxydecanoic acidLactic Acid Impurity 12315-HYDROXYPENTADECANOATE15-HydroxypentadecanoicAcid>Pentadecanoic acid, 15-hydroxy-15-Hydroxypentadecanoic acid 97%15-Hydroxypentadecanoic acid, 99+%

OMEGA-HYDROXYPENTADECANOIC ACID225-026-1MFCD0003953515-hydroxy-pentadecanoic acid15-HYDROXYPENTADECANOICACIDSCHEMBL600710UNII-FU65P3692Torb2664711

데이터베이스 식별자

CAS: 4617-33-8
PubChem CID: 78360
DTXSID: DTXSID00196750
ChEBI: CHEBI:79169
UNII: FU65P3692T
EC Number: 225-026-1
Nikkaji: J208.609C

물성

구조 계산 물성

XLogP: 4.2
극성 표면적: 57.5 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 3
회전 가능 결합 수: 14
무거운 원자 수: 18
형식 전하: 0
복잡도: 181

물리화학적 성질

녹는점: 85 · 85-89 °C(lit.)
끓는 점: 174 · 174-220 °C(Press: 4 Torr)
밀도: 0.963 · 0.963±0.06 g/cm3(Predicted)
저장 조건: 2 · 2-8°C
용해도: 클로로포름(약간 용해됨, 초음파 처리), DMSO(약간 용해됨)
산도 계수 (pKa): 4.78 · 4.78±0.10(Predicted)
물리적 상태: 고체
색상: 흰색에서 황백색까지
BRN: 1240100 · 1240100
InChI: InChI=1S/C15H30O3/c16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15(17)18/h16H,1-14H2,(H,17,18)
InChIKey: BZUNJUAMQZRJIP-UHFFFAOYSA-N
SMILES: C(O)(=O)CCCCCCCCCCCCCCO

화학적 성질

white to light yellow crystalline powder

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

유해성 정보

Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2 (100%)

안전 데이터

wgk: 3
HS 번호: 2915907098
hazard_code: Xi
safety_code: 24/25
기존화학 물질: KE-20787
위험 참고 사항: Irritant
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

응용 분야 · 3건

개요15-hydroxy Pentadecanoic acid is a hydroxylated fatty acid that has been used in the synthesis of the macrocyclic lactone musk compounds exaltolide and phoracantholide I. [Matreya, LLC. Catalog No. 1881]

용도15-Hydroxypentadecanoic acid is suitable reagent used in the following studies: As an internal standard in the quantification of formation of 11-hydroxylauric acid by gas chromatography.In the synthesis of [16-14C]16DCA (DCA= dicarboxylic acid) by one-carbon elongation procedure at C15.As an internal standard for the normalization of intensities in the mass spectra of plant cutin polymer.It may be used in the synthesis of 5-pentadecanolide on dealuminated HY zeolite and also fatty acid analog of podophyllotoxin.

일반 설명15-Hydroxypentadecanoic acid undergoes lactonization reaction catalyzed by Mucor javanicus L46 and Mucor miehei to afford macrocyclic mono- and oligolactone derivatives. Its lipase-catalyzed synthesis from 15-tetracosenoic acid in Malania Olcifera Chum oil has been proposed. It also participates in the biosynthesis of pentadecanolide.

상·하류 제품 정보

하류 제품

사이클로펜타카놀리드 Methyl 15-hydroxypentadecanoate

공급사50 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

河南萨克斯生物科技有限公司13803717460 · [email protected]

湖北永阔科技有限公司027-59223108 15972152991 · [email protected]

湖北万得化工有限公司15377098680 15377098680 · [email protected]

Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]

추가 설명

정의ChEBI: An omega-hydroxy fatty acid that is pentadecanoic acid in which one of the hydrogens of the terminal methyl group has been replaced by a hydroxy group.