4-(디에틸아미노)벤조익 산

Benzoic acid, 4-(diethylamino)-

HCID 79480
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기본 정보

CAS
5429-28-7
표준 SMILES
CCN(CC)c1ccc(C(=O)O)cc1
InChIKey
LNYTUARMNSFFBE-UHFFFAOYSA-N
분자식
C11H15NO2
평균 분자량
193.24 g/mol
단동위원소 질량
193.11027872

이름 및 식별자

우선 이름
Benzoic acid, 4-(diethylamino)-
IUPAC
4-(diethylamino)benzoic acid
현지명
4-(디에틸아미노)벤조익 산
영어명
4-Diethylaminobenzoic acid
분자식
C11H15NO2
분자량
193.24

이름 및 동의어

4-(Diethylamino)benzoic acid5429-28-7Benzoic acid, 4-(diethylamino)-p-(Diethylamino)benzoic acidNSC 14115EINECS 226-582-8DTXSID9063877RefChem:565918DTXCID8041666226-582-84-Diethylaminobenzoic AcidMFCD00002538
이름 더 보기
4-(디에틸아미노)벤조익산AKOS BBS-00003738RARECHEM AL BO 2370LABOTEST-BB LT008481914-(diethylamino)-benzoicaci4-Carboxy-N,N-diethylaniline4-DiethylaminobenzoicAcid>
4-N,N-Diethylaminobenzoic acidNSC-14115p-Diethylaminobenzoic aciddiethylaminobenzoic acid4-(diethylamino)benzoicChemDiv3_0141934-diethylamino benzoic acid4-diethylamino-benzoic acid

데이터베이스 식별자

CAS
5429-28-7
PubChem CID
79480
DTXSID
DTXSID9063877
ChEMBL
CHEMBL1535775
UNII
G7YGH249XU
EC Number
226-582-8
Nikkaji
J81.027D

물성

구조 계산 물성

XLogP
2.3
극성 표면적
40.5 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
3
회전 가능 결합 수
4
무거운 원자 수
14

물리화학적 성질

녹는점
192 · 192-193 °C(lit.)
끓는 점
329.46 °C · 329.46°C (rough estimate)
밀도
1.117 · 1.117
굴절률
1.5041 · 1.5041 (estimate)
인화점
175 °C · 175°C
저장 조건
Sealed in dry,Room Temperature

화학적 성질

light green fine crystalline powder

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (97.8%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 45 reports by companies from 5 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 Information · 2건

Chemical: Benzoic acid, 4-(diethylamino)-

Benzoic acid, 4-(diethylamino)-: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (97.8%)

규제 정보

Regulatory Information · 2건

Chemical: Benzoic acid, 4-(diethylamino)-

Benzoic acid, 4-(diethylamino)-: Does not have an individual approval but may be used under an appropriate group standard

안전 데이터

wgk
3
tsca
TSCA listed
HS 번호
29224999
risk_code
36/37/38
hazard_code
Xi
safety_code
26-37/39

화학 및 산업

용도 및 제조

General Manufacturing InformationBenzoic acid, 4-(diethylamino)-: ACTIVE

응용 분야

용도4-(Diethylamino)benzoic acid is used as a reactant in the preparation of amides by acylation of amines using (acyl)benzotriazoles.

상·하류 제품 정보

공급사69 곳

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
阿诺西（上海）生物技术有限公司400-1107768 15058188853 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
宁波君龙新材料有限公司0574 88552216 19032109277 · [email protected]

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