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HCID 98577생성일: 2026년 11월 5일

3,5-디오오도벤조산

3,5-디오오도벤조산 · 3,5-diiodobenzoate · 1,3-Diiodobenzoicacid · 3,5-diiodo-benzoicaci · 3,5-Diiodobenzoic acid · Benzoic acid, 3,5-diiodo- · tetrahydro-3-oxo-2-thiophenecarboxylicaci

https://huagongshe.com/ko/chemical/98577

식별자 및 물리적 특성

CAS No.	19094-48-5
분자식	C7H4I2O2
평균 분자량	373.91 g/mol
단동위원소 질량	373.83007 g/mol
SMILES	O=C(O)c1cc(I)cc(I)c1
InChIKey	FHTJRJBWLBXVPO-UHFFFAOYSA-N
PubChem CID	98577
EC No.	630-298-3
DTXSID	DTXSID30172603
현지명	3,5-디오오도벤조산

화학 및 물리적 성질

XLogP	2.7
극성 표면적	37.3
수소 결합 공여자 수	1
수소 결합 수용자 수	2
회전 가능 결합 수	1
무거운 원자 수	11
형식 전하	0
복잡도	151
녹는점	>230°C
끓는 점	424.2±35.0 °C(Predicted)
밀도	2.559±0.06 g/cm3(Predicted)
저장 조건	2-8°C(protect from light)
pKa(산도 계수)	3.50±0.10(Predicted)

안전 및 규제

GHS 분류	WarningH302 (33.3%): Harmful if swallowed [Warning Acute toxicity, oral]H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposureRespiratory tract irritation]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, 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 3 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.
Hazard Classes and Categories	Acute Tox. 4 (33.3%)Skin Irrit. 2 (100%)Eye Irrit. 2A (100%)STOT SE 3 (100%)
독성	mouse,LD50,intravenous,180mg/kg (180mg/kg),Journal of Organic Chemistry. Vol. 22, Pg. 1686, 1957.
관세 코드	2916399090
위험 문구(R)	36/37/38
위험 표시	Xi
안전 문구(S)	26-36/37/39

CAS No.

19094-48-5

분자식

C7H4I2O2

평균 분자량

373.91 g/mol

단동위원소 질량

373.83007 g/mol

SMILES

O=C(O)c1cc(I)cc(I)c1

InChIKey

FHTJRJBWLBXVPO-UHFFFAOYSA-N

PubChem CID

98577

EC No.

630-298-3

DTXSID

DTXSID30172603

현지명

3,5-디오오도벤조산

화학 및 물리적 성질

XLogP

2.7

극성 표면적

37.3

수소 결합 공여자 수

수소 결합 수용자 수

회전 가능 결합 수

무거운 원자 수

형식 전하

복잡도

151

녹는점

>230°C

끓는 점

424.2±35.0 °C(Predicted)

밀도

2.559±0.06 g/cm3(Predicted)

저장 조건

2-8°C(protect from light)

pKa(산도 계수)

3.50±0.10(Predicted)

안전 및 규제

GHS 분류

WarningH302 (33.3%): Harmful if swallowed [Warning Acute toxicity, oral]H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposureRespiratory tract irritation]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, 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 3 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.

Hazard Classes and Categories

Acute Tox. 4 (33.3%)Skin Irrit. 2 (100%)Eye Irrit. 2A (100%)STOT SE 3 (100%)

독성

mouse,LD50,intravenous,180mg/kg (180mg/kg),Journal of Organic Chemistry. Vol. 22, Pg. 1686, 1957.

관세 코드

2916399090

위험 문구(R)

36/37/38

위험 표시

안전 문구(S)

26-36/37/39