4-이미다졸 아크릴산

4-이미다졸 아크릴산
4-이미다졸 아크릴산 구조식 이미지
카스 번호:
104-98-3
한글명:
4-이미다졸 아크릴산
동의어(한글):
4-이미다졸아크릴산;우로카닉애씨드;유로칸산;우로칸산
상품명:
Urocanic acid
동의어(영문):
4-IMIDAZOLEACRYLIC ACID;(E)-3-(1H-imidazol-5-yl)acrylic acid;3-(1H-IMIDAZOL-4-YL)ACRYLIC ACID;SKL080;UROCANIC ACID;Urocanic caid;Urocalic acid;urocanoic acid;UROCANINIC ACID;Urocanic acid,99%
CBNumber:
CB8750635
분자식:
C6H6N2O2
포뮬러 무게:
138.12
MOL 파일:
104-98-3.mol
MSDS 파일:
SDS

4-이미다졸 아크릴산 속성

녹는점
226-228 °C(lit.)
끓는 점
253.51°C (rough estimate)
밀도
1.3471 (rough estimate)
굴절률
1.5100 (estimate)
저장 조건
Keep in dark place,Sealed in dry,2-8°C
용해도
1.5g/L
산도 계수 (pKa)
2.94±0.10(Predicted)
물리적 상태
가루
색상
흰색에서 베이지색
수용성
약간 용해됨
BRN
81405
InChI
InChI=1S/C6H6N2O2/c9-6(10)2-1-5-3-7-4-8-5/h1-4H,(H,7,8)(H,9,10)
InChIKey
LOIYMIARKYCTBW-UHFFFAOYSA-N
SMILES
C(O)(=O)C=CC1NC=NC=1
CAS 데이터베이스
104-98-3(CAS DataBase Reference)
EPA
2-Propenoic acid, 3-(1H-imidazol-4-yl)- (104-98-3)

안전

안전지침서 22-24/25
WGK 독일 3
RTECS 번호 NI3425200
위험 등급 IRRITANT
HS 번호 29332990
기존화학 물질 KE-20951

4-이미다졸 아크릴산 MSDS


3-(4-Imidazolyl)acrylic acid

4-이미다졸 아크릴산 C화학적 특성, 용도, 생산

화학적 성질

White to beige fine powder. 

용도

Urocanic Acid is a biomarker in the fecal metabolic profiling of breast cancer patients.

정의

ChEBI: Urocanic acid is an alpha,beta-unsaturated monocarboxylic acid that is prop-2-enoic acid substituted by a 1H-imidazol-4-yl group at position 3. It is a metabolite of hidtidine. It has a role as a chromophore and a human metabolite. It is an alpha,beta-unsaturated monocarboxylic acid and a member of imidazoles. It is a conjugate acid of a urocanate.

일반 설명

4-Imidazoleacrylic acid also known as urocanic acid is a natural metabolite derived from histidine. It is majorly used as a UV chromophore with a strong absorption spectrum in the UV-B region in the range of 300-280 nm.

Purification Methods

Crystallise the acid from water and dry it at 100o. The trans-isomer [3465-72-3] has m 225o (229-230o, 230-231o or 231o(dec, from H2O) and pK1 3.5 and pK2 5.6, and the picrate has m 225o(dec, from H2O). The cis-isomer [7699-35-6] has m 175-176o (178-179o or 180-184o dec, from H2O) and pK1 3.0 and pK2 6.7, and the picrate has m 204o (from H2O). [Beilstein 25 H 124, 25 I 536, 25 II 121, 25 III/IV 786.]

4-이미다졸 아크릴산 준비 용품 및 원자재

원자재

준비 용품


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