3-아미노-2,4,6-트리요오드벤조산

3-Amino-2,4,6-triiodobenzoic acid

HCID 18387CAS 3119-15-1

기본 정보

표준 SMILES
Nc1c(I)cc(I)c(C(=O)O)c1I
InChIKey
QMQFFHSJUJDRPG-UHFFFAOYSA-N
분자식
C7H4I3NO2
평균 분자량
514.83 g/mol
단동위원소 질량
514.7376

이름 및 식별자

우선 이름
3-Amino-2,4,6-triiodobenzoic acid
IUPAC
3-amino-2,4,6-triiodobenzoic acid
현지명
3-아미노-2,4,6-트리요오드벤조산
영어명
3-Amino-2,4,6-triiodobenzoic acid
분자식
C7H4I3NO2
분자량
514.83

이름 및 동의어

3-Amino-2,4,6-triiodobenzoic acid3119-15-1BENZOIC ACID, 3-AMINO-2,4,6-TRIIODO-99H77D8MTDNSC-60105DTXSID60185120RefChem:496902DTXCID70107611221-493-03-Amino-2,4,6-triiodo-benzoic acidC7H4I3NO2MFCD00007681
이름 더 보기
3-아미노-2,4,6-트리요오드벤조산3-amino-2,4,6-triiodo-benzoicaciacido3-amino-2,4,6-triiodobenzoico3-AMINO-2,4,6-TRIIODOBENZOIC ACID, 99+%3-Amino-2,4,6-triiodobenzoic Acid (50 mg)3-Amino-2,4,6-triiodobenzoic acid ISO 9001:2015 REACH3-Amino-2,4,6-triiodobenzoic acid, 99% (dry wt.), may cont. up to 1 mole of water
3-Amino-2,4,6-triiodo-BenzoicacidEINECS 221-493-0NSC 60105BRN 2113495UNII-99H77D8MTDAcido 3-amino-2,4,6-triiodobenzoico [Italian]NSC601052,4,6-triiodo-3-aminobenzoic acid

데이터베이스 식별자

CAS
3119-15-1
PubChem CID
18387
DTXSID
DTXSID60185120
UNII
99H77D8MTD
EC Number
221-493-0
Nikkaji
J76.318G

물성

구조 계산 물성

XLogP
2.7
극성 표면적
63.3 Ų
수소 결합 공여자 수
2
수소 결합 수용자 수
3
회전 가능 결합 수
1
무거운 원자 수
13

물리화학적 성질

녹는점
196 · 196-199 °C
끓는 점
478.9 · 478.9±45.0 °C(Predicted)
밀도
2.7479 · 2.7479 (estimate)
증기압
0.001 Pa · 0.001Pa at 25℃
저장 조건
2 · under inert gas (nitrogen or Argon) at 2–8 °C
산도 계수 (pKa)
1.5 · 1.50±0.10(Predicted)

화학적 성질

Light yellow to tan powder

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H302 (60.9%): Harmful if swallowed [Warning Acute toxicity, oral];H312 (55.1%): Harmful in contact with skin [Warning Acute toxicity, dermal];H315 (60.9%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H332 (55.1%): Harmful if inhaled [Warning Acute toxicity, inhalation];H335 (60.9%): 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 69 reports by companies from 3 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

Regulatory InformationStatus: Active Update: 04-05-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/24581
Hazard Classes and CategoriesAcute Tox. 4 (60.9%);Acute Tox. 4 (55.1%);Skin Irrit. 2 (60.9%);Eye Irrit. 2 (100%);Acute Tox. 4 (55.1%);STOT SE 3 (60.9%)

규제 정보

Regulatory InformationStatus: Active Update: 04-05-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/24581

안전 데이터

wgk
WGK 3
rtecs
DG3349000
독성
LD50 unr-rat: 1450 mg/kg JAPMA8 42,721,53
HS 번호
2922493800
risk_code
36/37/38-22-20/21/22
hazard_code
Xn

화학 및 산업

공급사50 곳

国药集团化学试剂有限公司86-21-63210123 · [email protected]
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
合肥胜航医药科技有限公司19156016681 18326946292 · [email protected]
湖北万得化工有限公司15377098680 15377098680 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]

관련 반응

12건

연결된 노트

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