2,6-나프탈렌디카본산
2,6-Naphthalenedicarboxylic acid
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기본 정보
- CAS
1141-38-4- 표준 SMILES
O=C(O)c1ccc2cc(C(=O)O)ccc2c1- InChIKey
RXOHFPCZGPKIRD-UHFFFAOYSA-N- 분자식
- C12H8O4
- 평균 분자량
- 216.19 g/mol
- 단동위원소 질량
- 216.04225873
개요
Naphthalene-2,6-dicarboxylic acid is a dicarboxylic acid. It derives from a hydride of a naphthalene.
이름 및 식별자
- 우선 이름
- 2,6-Naphthalenedicarboxylic acid
- IUPAC
- naphthalene-2,6-dicarboxylic acid
- 현지명
- 2,6-나프탈렌디카본산
- 영어명
- 2,6-NAPHTHALENEDICARBOXYLIC ACID
- 분자식
- C12H8O4
- 분자량
- 216.19
이름 및 동의어
2,6-Naphthalenedicarboxylic acid1141-38-4naphthalene-2,6-dicarboxylic acid2,6-NAPHTHALIC ACID2,6-DICARBOXYNAPHTHALENEDTXSID5029211K3C4DYZ29ODTXCID009211CHEBI:44460RefChem:445809214-527-0MFCD00004105
이름 더 보기
2,6-나프탈렌다이카르복시산2,6-나프탈렌디카본산DK7461NSC 96410JACS-1141-38-4TIMTEC-BB SBB008377Adiphenine Impurity 112,6-Naphthalenedioic acid2,6-phthalenedicarboxylic Acid
2,6-napthalenedicarboxylic acidNCIOpen2_0071242,6-Naphthalendicarboxylic acid2,6-naphthalene-dicarboxylic acidNSC-964102,6-Naphthalic Acid||||NSC 96410NAPHTHALENEDICARBOXYLIC ACID, 2,6-2,6-naphthalene dicarboxylic acid
데이터베이스 식별자
- CAS
1141-38-4- PubChem CID
- 14357
- DTXSID
DTXSID5029211- ChEMBL
CHEMBL1205452- ChEBI
CHEBI:44460- UNII
- K3C4DYZ29O
- EC Number
- 214-527-0
- Nikkaji
- J40.510H
물성
구조 계산 물성보충 중
- XLogP
- 2.8
- 극성 표면적
- 74.6 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 16
- 형식 전하
- 0
- 복잡도
- 269
실험 및 물리화학적 성질
DrugsPharmaceuticals -> Listed in ZINC15
Food Contact Substances
FCS -> FDA Cumulative Estimated Daily Intake (CEDI)
FCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR
Physical DescriptionDry Powder
물리화학적 성질
- 녹는점
- 300 °C · >300 °C (lit.)
- 끓는 점
- 316.6 °C · 316.6°C (rough estimate)
- 밀도
- 1.5 · 1.5
- 굴절률
- 1.708 · 1.7080 (estimate)
- 저장 조건
- Sealed in dry,Room Temperature
- 용해도
- very faint turbidity in hot Pyridine
- 산도 계수 (pKa)
- 3.69 · 3.69±0.30(Predicted)
- 물리적 상태
- 가루
- 색상
- 하얀색
- 수용성
- 3 μg/L · 3μg/L at 20℃
- BRN
- 2051257 · 2051257
- InChI
- InChI=1S/C12H8O4/c13-11(14)9-3-1-7-5-10(12(15)16)4-2-8(7)6-9/h1-6H,(H,13,14)(H,15,16)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 83.3% (15 of 18) of all reports.
Warning
H315 (16.7%): Causes skin irritation [Warning Skin corrosion/irritation]
P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)
Aggregated GHS information provided per 18 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Regulatory Information
Chemical: 2,6-Naphthalenedicarboxylic acid
2,6-Naphthalenedicarboxylic acid is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 2,6-Naphthalenedicarboxylic 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)
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
REACH registered substance: Naphthalene-2,6-dicarboxylic acid (EC: 214-527-0)
2,6-Naphthalenedicarboxylic acid: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Hazard Classes and CategoriesSkin Irrit. 2 (16.7%)
안전 데이터
- wgk
- 3
- tsca
- TSCA listed
- HS 번호
- 29173990
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 24/25
- 위험 등급
- IRRITANT
화학 및 산업
용도 및 제조
U.S. Production2023: <75,000 lb
Consumer UsesMonomers
Industry UsesMonomers
General Manufacturing Information
Plastics Material and Resin Manufacturing
2,6-Naphthalenedicarboxylic acid: ACTIVE
응용 분야
용도2,6-naphthalenedicarboxylic acid is an important product for the manufacture of high strength and excellent dyeing properties of polyester fibers and F class insulation material, is an important monomer performance PEN, PBN, liquid crystal polymer (LCP) and polyurethane resin pharmaceutical and fine chemicals raw material.
일반 설명This product has been enhanced for energy efficiency.
상·하류 제품 정보
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