Uracil (HCID 1174)｜Huagongshe

이름 및 식별자

우선 이름: Uracil
IUPAC: 1H-pyrimidine-2,4-dione
영어명: URACIL-5-D1
분자식: C4H3DN2O2
분자량: 113.09

이름 및 동의어

uracil66-22-8pyrimidine-2,4(1H,3H)-dione2,4(1H,3H)-PyrimidinedionePyrodHybar X2,4-DioxopyrimidinePirod2,4-Pyrimidinedione1H-Pyrimidine-2,4-dione1,2,3,4-tetrahydropyrimidine-2,4-dioneDTXSID4021424

이름 더 보기

Nsc29742Uracil-5-Uracil-5-DURACIL-5-D1[6-2H]-UracilURACIL (5-D, 98%)

NSC-3970SQ-6201SQ-7726SQ-8493CHEBI:17568BMS-205603-0156HH86ZVCTNSC3970

데이터베이스 식별자

CAS: 24897-50-5、2920-92-5、51953-14-1、51953-20-9、66-22-8
PubChem CID: 1174
DTXSID: DTXSID4021424
ChEMBL: CHEMBL566
ChEBI: CHEBI:17568
UNII: 56HH86ZVCT
EC Number: 200-621-9
Nikkaji: J4.842I

물성

구조 계산 물성

XLogP: -1.1
극성 표면적: 58.2 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 2
회전 가능 결합 수: 0
무거운 원자 수: 8
형식 전하: 0
복잡도: 161

실험 및 물리화학적 성질

LogP · 2건

-1.07

LogS-1.48

Solubility · 2건

3600

3.6 mg/mL

Melting Point · 2건

338

330 °C

Caco2 Permeability-5.37

Physical Description · 2건

Solid; [Merck Index] White powder; [Alfa Aesar MSDS]

Solid

물리화학적 성질

CAS Number Unlabeled: 66 · 66-22-8

안전 및 규제

GHS 분류

GHS Classification · 6건

This chemical does not meet GHS hazard criteria for 82.4% (14 of 17) of all reports.

Warning

H315 (11.8%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (11.8%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (11.8%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 17 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Reported as not meeting GHS hazard criteria per 14 of 17 reports by companies.；There are 3 notifications provided by 3 of 17 reports by companies with hazard statement code(s).；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

유해성 정보

Regulatory Information · 2건

Status: Active Update: 31-01-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/19811

2,4(1H,3H)-Pyrimidinedione: Does not have an individual approval but may be used under an appropriate group standard

Other Safety InformationIMAP assessments - 2,4(1H,3H)-Pyrimidinedione: Environment tier I assessment；IMAP assessments - 2,4(1H,3H)-Pyrimidinedione: Human health tier I assessment

Hazards SummaryMay cause irritation; [Alfa Aesar MSDS] See Uracil.

Hazard Classes and CategoriesSkin Irrit. 2 (11.8%)；Eye Irrit. 2A (11.8%)；STOT SE 3 (11.8%)

규제 정보

Regulatory Information · 2건

Status: Active Update: 31-01-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/19811

2,4(1H,3H)-Pyrimidinedione: Does not have an individual approval but may be used under an appropriate group standard

화학 및 산업

약리 정보

Tissue LocationsAll Tissues；Placenta；Prostate

Cellular LocationsExtracellular

Metabolite Pathways · 1건

Beta Ureidopropionase Deficiency；beta-Alanine metabolism；Carnosinuria, carnosinemia；Dihydropyrimidinase Deficiency；GABA-Transaminase Deficiency；MNGIE (Mitochondrial Neurogastrointestinal Encephalopathy)；Pyrimidine metabolism；UMP Synthase Deficiency (Orotic Aciduria)；Ureidopropionase Deficiency