6-Amino-1,3-naphthalenedisulfonic acid

HCID 8356CAS 118-33-2

기본 정보

표준 SMILES: Nc1ccc2c(S(=O)(=O)O)cc(S(=O)(=O)O)cc2c1
InChIKey: KZCSUEYBKAPKNH-UHFFFAOYSA-N
분자식: C10H9NO6S2
평균 분자량: 303.3 g/mol
단동위원소 질량: 302.98712901

이름 및 식별자

우선 이름: 6-Amino-1,3-naphthalenedisulfonic acid
IUPAC: 6-aminonaphthalene-1,3-disulfonic acid
영어명: 2-Naphthylamine-5,7-disulfonic acid
분자식: C10H9NO6S2
분자량: 303.31

이름 및 동의어

118-33-26-Amino-1,3-naphthalenedisulfonic acid1,3-Naphthalenedisulfonic acid, 6-amino-6-Aminonaphthalene-1,3-disulphonic acidVP7LWM9S94NSC-4157DTXSID80594714-14-00-02811 (Beilstein Handbook Reference)6-AMINO-3-SULFONAPHTHALENE-1-SULFONIC ACIDRefChem:104161DTXCID80334316-aminonaphthalene-1,3-disulfonic acid

이름 더 보기

amino-iacidAMINO J-ACIDkyselinaamino-i2-Naphthylamin-5,7-disulfonsure2-naftylamin-5,7-disulfonansodny6-amino-1,3-naphthalenedisulfonic2-Naphthylamine-5,7-disulfonicaci6-amino-3-naphthalenedisulfonicacid2-Naphthylamine-5,7-disulfonicaacid

2-Aminonaphthalene-5,7-disulfonic acid2-NAPHTHYLAMINE-5,7-DISULFONIC ACIDKyselina amino-IAmino-I acidAmino-J acidAmino-J-acidMFCD000215132-Naftylamin-5,7-disulfonan sodny

데이터베이스 식별자

CAS: 118-33-2
PubChem CID: 8356
DTXSID: DTXSID8059471
UNII: VP7LWM9S94
EC Number: 204-246-1
Nikkaji: J90.818E

물성

구조 계산 물성

XLogP: 0
극성 표면적: 152 Å²
수소 결합 공여자 수: 3
수소 결합 수용자 수: 7
회전 가능 결합 수: 2
무거운 원자 수: 19
형식 전하: 0
복잡도: 531

물리화학적 성질

끓는 점: 568.34 ℃[at · 568.34℃[at 101 325 Pa]
밀도: 1.769 · 1.769±0.06 g/cm3(Predicted)
증기압: 0 Pa · 0Pa at 25℃
저장 조건: 2 · 2-8°C, protect from light
산도 계수 (pKa): -0.91 · -0.91±0.40(Predicted)
수용성: 229 g/L · 229g/L at 15℃
InChI: InChI=1S/C10H9NO6S2/c11-7-1-2-9-6(3-7)4-8(18(12,13)14)5-10(9)19(15,16)17/h1-5H,11H2,(H,12,13,14)(H,15,16,17)
InChIKey: KZCSUEYBKAPKNH-UHFFFAOYSA-N
SMILES: C1(S(O)(=O)=O)=C2C(C=C(N)C=C2)=CC(S(O)(=O)=O)=C1
LogP: -1.85 · -1.85
EPA: 1 · 1,3-Naphthalenedisulfonic acid, 6-amino- (118-33-2)

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.

유해성 정보

Regulatory Information · 2건

Status: Cease Manufacture Update: 04-08-2017 https://echa.europa.eu/registration-dossier/-/registered-dossier/20054

6-amino-1,3-naphthalenedisulfonic acid: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesAcute Tox. 4 (100%)

안전 데이터

tsca: TSCA listed
ridadr: 1759
독성: rat,LD50,oral,2gm/kg (2000mg/kg),"Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986Vol. -, Pg. 1059, 1986.
포장분류: III
위험 등급: 8

화학 및 산업

용도 및 제조

General Manufacturing Information1,3-Naphthalenedisulfonic acid, 6-amino-: INACTIVE

상·하류 제품 정보

상류 원료

베타-나프틸아민 Trisulfonic acid

하류 제품

2-아미노-5-히드록시-1,7-나프탈렌디술폰산 C.I. Direct red 42

공급사50 곳

湖北永阔科技有限公司027-59223108 15972152991 · [email protected]

杭州品高化工有限公司0571-87658025 · [email protected]

宁波万核化学科技有限公司+86-15827200700 · [email protected]

Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]

毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]

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