4-(벤질아미노)페놀

4-(Benzylamino)phenol

HCID 7637

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 103-14-0
표준 SMILES: Oc1ccc(NCc2ccccc2)cc1
InChIKey: SRYYOKKLTBRLHT-UHFFFAOYSA-N
분자식: C13H13NO
평균 분자량: 199.25 g/mol
단동위원소 질량: 199.09971404

이름 및 식별자

우선 이름: 4-(Benzylamino)phenol
IUPAC: 4-(benzylamino)phenol
현지명: 4-(벤질아미노)페놀
영어명: 4-(BENZYLAMINO)PHENOL
분자식: C13H13NO
분자량: 199.25

이름 및 동의어

4-(Benzylamino)phenol103-14-0Phenol, 4-[(phenylmethyl)amino]-p-benzylaminophenolp-(Benzylamino)phenol4-[(Phenylmethyl)amino]phenolN-Benzyl-p-aminophenolPhenol, 4-((phenylmethyl)amino)-EINECS 203-082-8BRN 1874039AI3-019314-(N-Benzylamino)phenol

이름 더 보기

4-(벤질아미노)페놀4-(Benzylamino)p-Benzylaminoethanolp-(benzylamino)-pheno4-n-benzylaminophenolp-(N-Benzylamino)phenolPhenol, p-(benzylamino)-

DTXSID8059269SRYYOKKLTBRLHT-UHFFFAOYSA-3-13-00-01027 (Beilstein Handbook Reference)4-[benzylamino]phenol4-((Phenylmethyl)amino)phenolRefChem:97344DTXCID8032756InChI=1/C13H13NO/c15-13-8-6-12(7-9-13)14-10-11-4-2-1-3-5-11/h1-9,14-15H,10H2

데이터베이스 식별자

CAS: 103-14-0
PubChem CID: 7637
DTXSID: DTXSID8059269
EC Number: 203-082-8
Nikkaji: J50.088G

물성

구조 계산 물성

XLogP: 2.8
극성 표면적: 32.3 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 2
회전 가능 결합 수: 3
무거운 원자 수: 15
형식 전하: 0
복잡도: 169

실험 및 물리화학적 성질

Physical DescriptionBrown solid; [Alfa Aesar MSDS]

물리화학적 성질

녹는점: 83 °C · 83 °C
끓는 점: 195 °C · 195 °C / 5mmHg
밀도: 1.0671 · 1.0671 (rough estimate)
굴절률: 1.55 · 1.5500 (estimate)
저장 조건: Keep in dark place,Inert atmosphere,Room temperature
산도 계수 (pKa): 11 · 11.00±0.26(Predicted)
BRN: 1874039 · 1874039
EPA: 4 · Phenol, 4-[(phenylmethyl)amino]- (103-14-0)

화학적 성질

Light brown powder. Solubility of 50% in anhydrous methanol, 50% in 95% ethanol, 0.06% in water; 0.1–0.5% in gasoline, varying with chemical nature of gasoline.

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (20%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (20%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P264, P264+P265, P270, P280, P301+P317, P302+P352, P305+P351+P338, P321, P330, P332+P317, P337+P317, P362+P364, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 5 reports by companies from 2 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

Hazards SummaryMay cause irritation; Harmful by ingestion; [Alfa Aesar MSDS]

Hazard Classes and CategoriesAcute Tox. 4 (100%)；Skin Irrit. 2 (20%)；Eye Irrit. 2 (20%)

안전 데이터

tsca: TSCA listed
rtecs: SJ7580000
독성: LDLo orl-rat: 500 mg/kg JPETAB 90,260,47
HS 번호: 2922290090
risk_code: 20/21/22
safety_code: 26-36/37/39
위험 등급: IRRITANT

화학 및 산업

용도 및 제조

General Manufacturing InformationPhenol, 4-[(phenylmethyl)amino]-: INACTIVE

응용 분야

용도In cracked gasoline, in concentration of 0.001– 0.004% by weight to prevent gum formation.

상·하류 제품 정보

상류 원료

공급사41 곳

河北凡博医药科技有限公司15588346797

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]

上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]

安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]

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