푸란-2-카르복실산

2-Furancarboxylic acid

HCID 6919CAS 26447-28-9
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
O=C(O)c1ccco1
InChIKey
SMNDYUVBFMFKNZ-UHFFFAOYSA-N
분자식
C5H4O3
평균 분자량
112.08 g/mol
단동위원소 질량
112.01604399

개요

2-furoic acid is a furoic acid having the carboxylic acid group located at position 2. It has a role as an inhibitor, a Saccharomyces cerevisiae metabolite, a plant metabolite, a human xenobiotic metabolite and a bacterial xenobiotic metabolite. It is a conjugate acid of a 2-furoate.

이름 및 식별자

우선 이름
2-Furancarboxylic acid
IUPAC
furan-2-carboxylic acid
현지명
2-퓨로산
영어명
Furancarboxylic acid
분자식
C5H4O3
분자량
112.08

이름 및 동의어

2-FUROIC ACID88-14-22-Furancarboxylic acidPyromucic acid2-Carboxyfuranalpha-Furoic acid2-furanoic acidalpha-Furancarboxylic acidDTXSID6041420NSC-8842P577F6494ADTXCID4021420
이름 더 보기
2-퓨로산
CHEBI:30845NSC-58965RefChem:909849201-803-0Furan-2-carboxylic acidFUROIC ACIDFurancarboxylic acid26447-28-9

데이터베이스 식별자

CAS
26447-28-9、88-14-2
PubChem CID
6919
DTXSID
DTXSID6041420
ChEMBL
CHEMBL1232797
ChEBI
CHEBI:30845
UNII
P577F6494A
EC Number
201-803-0、247-713-5
Nikkaji
J4.288I

물성

구조 계산 물성

XLogP
0.5
극성 표면적
50.4 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
3
회전 가능 결합 수
1
무거운 원자 수
8

실험 및 물리화학적 성질

SpringerMaterials PropertiesBoiling point
LogP · 2건

0.64

0.64

Flavoring AgentsEU Flavoring substances
Solubility37.1 mg/mL at 15 °C
Boiling Point230.00 to 232.00 °C. @ 760.00 mm Hg
Melting Point133.5 °C

물리화학적 성질

녹는점
133 °C · 133°C
끓는 점
149.97 °C · 149.97°C (rough estimate)
밀도
1.2552 · 1.2552 (rough estimate)
굴절률
1.439 · 1.4390 (estimate)
EPA
Furancarboxylic acid (26447-28-9)

안전 및 규제

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 34.8% (89 of 256) of reports.

Warning

H315 (64.5%): Causes skin irritation [Warning Skin corrosion/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 256 reports by companies from 18 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 6건

Chemical: 2-Furancarboxylic acid

Chemical: Furancarboxylic acid

Commission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)

2-Furancarboxylic acid is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 2-Furancarboxylic acid 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)

Status: Active Update: 01-08-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/20061

2-Furancarboxylic acid: Does not have an individual approval but may be used under an appropriate group standard

Other Safety Information · 2건

IMAP assessments - Furancarboxylic acid: Environment tier I assessment

IMAP assessments - 2-Furancarboxylic acid: Human health tier I assessment

Hazard Classes and CategoriesSkin Irrit. 2 (64.5%)

안전 데이터

tsca
TSCA listed

화학 및 산업

용도 및 제조

U.S. Production2023: 46,843 lb
Consumer UsespH regulating agent
General Manufacturing Information · 2건

2-Furancarboxylic acid: ACTIVE

Furancarboxylic acid: INACTIVE

공급사10 곳

武汉丰泰威远科技有限公司+86-27-8746-5837 +86-18627785180 · [email protected]
武汉丰泰威远科技有限公司027-87465837 19945049750 · [email protected]
Xiamen Eagle Chemical Limited Corporation+86-18900207489 · [email protected]
LUYUNJIA CHEMISTRY XIAMEN LIMITED+86-592-5360779 +86-13055435203
潍坊市伟蒙化工有限公司QQ 1340191485 15105445095 · [email protected]

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