나프탈렌술폰산
1-Naphthalenesulfonic acid
기본 정보
- CAS
25155-19-5- 표준 SMILES
O=S(=O)(O)c1cccc2ccccc12- InChIKey
PSZYNBSKGUBXEH-UHFFFAOYSA-N- 분자식
- C10H8O3S
- 평균 분자량
- 208.24 g/mol
- 단동위원소 질량
- 208.01941529
개요
Naphthalene-1-sulfonic acid is a naphthalenesulfonic acid.
이름 및 식별자
- 우선 이름
- 1-Naphthalenesulfonic acid
- IUPAC
- naphthalene-1-sulfonic acid
- 현지명
- 나프탈렌술폰산
- 영어명
- naphthalenesulphonic acid
- 분자식
- C10H8O3S
- 분자량
- 208.23372
이름 및 동의어
1-NAPHTHALENESULFONIC ACID85-47-2naphthalene-1-sulfonic acidalpha-Naphthalenesulfonic acid1-naphthalenemonosulfonate0SJH61WM2JDTXSID7048033HT-907CHEBI:30895RefChem:76474DTXCID209777201-610-1
이름 더 보기
나프탈렌술폰산Einecs 246-676-2
Naphthalenesulphonic acidnaphthalenesulfonic acidNaphthalene-1-sulphonic acid25155-19-5UNII-0SJH61WM2J1-sulfonaphthaleneMFCD00003987.alpha.-Naphthalenesulfonic acid
데이터베이스 식별자
- CAS
25155-19-5、85-47-2- PubChem CID
- 6812
- DTXSID
DTXSID7048033- ChEMBL
CHEMBL1160029- ChEBI
CHEBI:30895- UNII
- 0SJH61WM2J
- EC Number
- 201-610-1、246-676-2
- Nikkaji
- J124.113C
물성
구조 계산 물성
- XLogP
- 1.9
- 극성 표면적
- 62.8 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 1
- 무거운 원자 수
- 14
- 형식 전하
- 0
- 복잡도
- 291
실험 및 물리화학적 성질
Chemical Classes
Other Classes -> Naphthalenes
Industrial compound
Food Contact SubstancesFCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR
Physical DescriptionSolid; [Merck Index] Grey powder; [Acros Organics MSDS]
Ionization Efficiency
Negative
1.6
10.5
Agilent XCT
Electrospray ionization
ammonia (10nM)
Collision Cross Section141.6 Ų [M-H]- [CCS Type: DT; Buffer gas: N2; Ionization: ESI-; Dataset: TOXCAST; Source Identifier: DTXSID3042394]
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 57.8% (155 of 268) of all reports.
Danger
H302 (39.9%): Harmful if swallowed [Warning Acute toxicity, oral]
P260, P264, P264+P265, P270, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P363, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 268 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
This chemical does not meet GHS hazard criteria for 4.4% (2 of 45) of reports.
유해성 정보
Regulatory Information
Chemical: Naphthalenesulfonic acid
Naphthalenesulfonic 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.
1-Naphthalenesulfonic acid: Does not have an individual approval but may be used under an appropriate group standard
Hazards SummaryCauses burns; Inhalation may cause corrosive injuries to upper respiratory tract and lungs; [Acros Organics MSDS] See Naphthalene.
Hazard Classes and Categories
Acute Tox. 4 (39.9%)
Skin Corr. 1B (95.6%)
독성 정보
Adverse EffectsDermatotoxin - Skin burns.
안전 데이터
- ridadr
- 2585
- HS 번호
- 2904100000
화학 및 산업
용도 및 제조
UsesUsed to make alpha-naphthol; The sodium salt is used to make phenols soluble in water; [Merck Index]
General Manufacturing Information1-Naphthalenesulfonic acid: ACTIVE
관련 반응
17건
화합물 노트
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