5-니트로푸르푸릴알코올

5-Nitrofurfuryl alcohol

HCID 17230CAS 2493-04-1
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
O=[N+]([O-])c1ccc(CO)o1
InChIKey
NDSTUUPEXNCUNW-UHFFFAOYSA-N
분자식
C5H5NO4
평균 분자량
143.1 g/mol
단동위원소 질량
143.02185764

이름 및 식별자

우선 이름
5-Nitrofurfuryl alcohol
IUPAC
(5-nitrofuran-2-yl)methanol
현지명
5-니트로푸르푸릴알코올
영어명
5-Nitrofurfuryl alcohol
분자식
C5H5NO4
분자량
143.1

이름 및 동의어

5-Nitrofurfuryl alcohol2493-04-1FURFURYL ALCOHOL, 5-NITRO-AI3-23604NSC 6454BRN 0123848DTXSID60179640Furan, 2-hydroxymethyl-5-nitro-5-17-03-00350 (Beilstein Handbook Reference)RefChem:103266DTXCID20102131624-864-9
이름 더 보기
5-니트로푸르푸릴알코올5-Nitrofuryl alcohol(5-Nitrofuran-2-yl)5-nitro-2-furanmethano5-nitro-furfurylalcoho5-NITRO-2-FURFURYL ALCOHOL2-Furanmethanol, 5-nitro- (9CI)
NDSTUUPEXNCUNW-UHFFFAOYSA-N(5-nitrofuran-2-yl)methanol2-Furanmethanol, 5-nitro-5-Nitro-2-furanmethanol2-Furfuryl alcohol, 5-nitro-2-Hydroxymethyl-5-nitrofuranMFCD00272267NSC-6454

데이터베이스 식별자

CAS
2493-04-1
PubChem CID
17230
DTXSID
DTXSID60179640
UNII
SD64757V5Y
EC Number
624-864-9
Nikkaji
J37.041J

물성

구조 계산 물성

XLogP
0.4
극성 표면적
79.2 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
4
회전 가능 결합 수
1
무거운 원자 수
10

물리화학적 성질

녹는점
30 · 30-32 °C
끓는 점
104 · 104-105 °C/3 mmHg (lit.)
밀도
1.283 g/mL · 1.283 g/mL at 25 °C (lit.)
굴절률
20 · n20/D 1.582(lit.)
인화점
230 °F · >230 °F
저장 조건
2 · 2-8°C

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；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

Hazard Classes and CategoriesAcute Tox. 4 (100%)；Acute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；Acute Tox. 4 (100%)；STOT SE 3 (100%)

안전 데이터

wgk
3
rtecs
LU9174000
HS 번호
2932190090
risk_code
20/21/22-36/37/38
hazard_code
Xn
safety_code
26-36

화학 및 산업

응용 분야 · 2건

개요Nitrofurfuryl alcohol has been used as an antibacterial, antiprotozoal, and antihelminthic drug in human and animals. The mechanism of nitrofurfuryl alcohol toxicity is not clear but the nitro group is believed responsible for the carcinogenicity and mutagenicity of nitrofurfuryl alcohol.

용도5-Nitrofurfuryl alcohol was used to investigate the reduction of some 2-substituted-5-nitrofuran compounds by rhodium complex [Rh(COD)(2-picoline)2](PF6) (COD = 1,5-cyclooctadiene) anchored on poly(4-vinylpyridine). It may be used for the synthesis of 5-nitrofurfuryl bromide and 5-nitrofurfurylamine hydrochloride.

상·하류 제품 정보

공급사39 곳

陕西缔都新材料有限公司81124267 17392282731 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
怀化元研达生物技术有限责任公司18711085600 · [email protected]
普善实业（陕西）有限公司029-81310890 18165209495 · [email protected]

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