이소니코틴산

이소니코틴산
이소니코틴산 구조식 이미지
카스 번호:
55-22-1
한글명:
이소니코틴산
동의어(한글):
아이소나이코타이산;이소니코틴산
상품명:
Isonicotinic acid
동의어(영문):
INA;4-PYRIDINECARBOXYLIC ACID;4-PICOLINIC ACID;PYRIDINE-4-CARBOXYLIC ACID;PYRIDINE-3-CARBOXYLIC ACID;Isonicotic acid;Isonicotinic;4-Carboxypyridine;NEF5;bidinjiausn
CBNumber:
CB1462924
분자식:
C6H5NO2
포뮬러 무게:
123.11
MOL 파일:
55-22-1.mol
MSDS 파일:
SDS

이소니코틴산 속성

녹는점
≥300 °C (lit.)
끓는 점
260 °C (15 mmHg)
밀도
1,47g/cm
굴절률
1.5423 (estimate)
인화점
260°C/15mm
저장 조건
no restrictions.
용해도
6g/L
산도 계수 (pKa)
4.96(at 25℃)
물리적 상태
가루
색상
노란색에서 황갈색까지
수소이온지수(pH)
3-4 (6g/l, H2O, 20℃)(saturated solution)
수용성
5.2g/L(20℃)
Merck
14,5187
BRN
109599
InChIKey
TWBYWOBDOCUKOW-UHFFFAOYSA-N
CAS 데이터베이스
55-22-1(CAS DataBase Reference)
NIST
Isonicotinic acid(55-22-1)
EPA
Isonicotinic acid (55-22-1)
안전
  • 위험 및 안전 성명
  • 위험 및 사전주의 사항 (GHS)
위험품 표기 Xi
위험 카페고리 넘버 36/37/38
안전지침서 26-36
WGK 독일 2
RTECS 번호 NS1103000
TSCA Yes
HS 번호 29333999
독성 LD50 orally in Rabbit: 5000 mg/kg
그림문자(GHS): GHS hazard pictograms
신호 어: Warning
유해·위험 문구:
암호 유해·위험 문구 위험 등급 범주 신호 어 그림 문자 P- 코드
H319 눈에 심한 자극을 일으킴 심한 눈 손상 또는 자극성 물질 구분 2A 경고 GHS hazard pictograms P264, P280, P305+P351+P338,P337+P313P
예방조치문구:
P264 취급 후에는 손을 철저히 씻으시오.
P264 취급 후에는 손을 철저히 씻으시오.
P280 보호장갑/보호의/보안경/안면보호구를 착용하시오.
P305+P351+P338 눈에 묻으면 몇 분간 물로 조심해서 씻으시오. 가능하면 콘택트렌즈를 제거하시오. 계속 씻으시오.
P337+P313 눈에 대한 자극이 지속되면 의학적인 조치· 조언를 구하시오.
NFPA 704
1
2 0

이소니코틴산 MSDS


Isonicotinic acid

이소니코틴산 C화학적 특성, 용도, 생산

화학적 성질

isonicotinic acid is also known as pyridine-4-carboxylic acid. white to light yellow crystal powder or white needle crystals. odorless, sublimable. molecular weight 123.11. melting point 319°C . slightly soluble in cold water, soluble in hot water, insoluble in alcohol, benzene and ether. isonicotinic acid is an amphoteric compound that is soluble in both acids and bases. soluble in hot water and ethanol, slightly soluble in cold water and ether. stable to heat and oxidation.

용도

Isonicotinic acid is a metabolite of isoniazid. It is an isomer of nicotinic acid. The chronic toxicity of isonicotinic acid is slightly higher than that of isonicotinic acid hydrazide ( INH ) .
Isonicotinic acid is a moderately basic compound (based on its pKa). Isonicotinic acid is an organic compound with a carboxyl group on a pyridine ring. The carboxyl group for isonicotinic acid is on the 4-position instead of the 3-position for nicotinic acid. It is an isomer of nicotinic acid. Isonicotinic acid is a metabolite of isoniazid.
Isonicotinic acid considered to be inactive isomer of nicotinic acid. Isonicotinic acid is a metabolite of pyridine-4-carboxy hydrazide (isonicotinyl hydrazide; isoniazid) a front-line weapon in the battle against tuberculosis. Isonicotinic acid and its derivatives are used in manufacturing pharmaceuticals and agrochemicals.
Used in the biological study of differentiation induced by nicotinic acid, nicotinamide and isonicotinic acid in human leukemia cell lines

정의

ChEBI: Isonicotinic acid is a pyridinemonocarboxylic acid in which the carboxy group is at position 4 of the pyridine ring. It has a role as a human metabolite and an algal metabolite. It is a conjugate acid of an isonicotinate.

제조 방법

Isonicotinic acid is synthesized by continuous oxidation with 4-methylpyridine as raw material and vanadium pentoxide as catalyst. The purity of the industrial product isonicotinic acid is more than 95%, and the yield of the above method is 70-75%. The consumption of 4-methylpyridine per ton of product is 1070kg.

주요 응용

Isonicotinic acid (IN) can be used as:
An organocatalyst in the one pot four component condensation reaction, to synthesize pyranopyrazoles based heterocyclic compounds.
An organic ligand for the preparation of copper(I) halide coordination polymer [CuBr(IN)]n, by hydrothermal method.
As a starting material for the synthesis of cation-dimers with potent antimalarial activity.

Purification Methods

Crystallise the acid repeatedly from water and dry it under vacuum at 110o or sublime it at 260o/15mm (m 319o). [Beilstein 22 III/IV 518, 22/2 V 188.]

이소니코틴산 준비 용품 및 원자재

원자재

준비 용품


이소니코틴산 공급 업체

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