2-아미노-4-페닐페놀

2-Amino-4-phenylphenol

HCID 14562CAS 1134-36-7

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: Nc1cc(-c2ccccc2)ccc1O
InChIKey: IGIDZGNPFWGICD-UHFFFAOYSA-N
분자식: C12H11NO
평균 분자량: 185.22 g/mol
단동위원소 질량: 185.08406397

이름 및 식별자

우선 이름: 2-Amino-4-phenylphenol
IUPAC: 2-amino-4-phenylphenol
현지명: 2-아미노-4-페닐페놀
영어명: 2-AMINO-4-PHENYLPHENOL
분자식: C12H11NO
분자량: 185.22

이름 및 동의어

2-Amino-4-phenylphenol1134-36-73-Amino-4-hydroxybiphenyl3-Aminobiphenyl-4-ol[1,1'-Biphenyl]-4-ol, 3-amino-2-Hydroxy-5-phenylaniline4-Biphenylol, 3-amino-Phenol, 2-amino-4-phenyl-EINECS 214-484-8(1,1'-Biphenyl)-4-ol, 3-amino-4-phenyl-2-aminophenolNSC 7950

이름 더 보기

2-아미노-4-페닐페놀nsc79503-amino-4-biphenyloLABOTEST-BB LT000892503-AMINO-4-PHENYLPHENOL2-azanyl-4-phenyl-phenol

DTXSID8061553NSC-79503-AMINO-4-BIPHENYLOL3D49P06660AMINO-(1,1'-BIPHENYL)-4-OL, 3-RefChem:464369DTXCID60333263-Amino-[1,1'-biphenyl]-4-ol

데이터베이스 식별자

CAS: 1134-36-7
PubChem CID: 14562
DTXSID: DTXSID8061553
ChEMBL: CHEMBL574583
ChEBI: CHEBI:105700
UNII: 3D49P06660
EC Number: 214-484-8
Nikkaji: J39.597H

물성

구조 계산 물성

XLogP: 2.4
극성 표면적: 46.3 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 2
회전 가능 결합 수: 1
무거운 원자 수: 14
형식 전하: 0
복잡도: 177

물리화학적 성질

녹는점: 198 · 198-202 °C (lit.)
끓는 점: 356 · 356.0±35.0 °C(Predicted)
밀도: 1.191 · 1.191±0.06 g/cm3(Predicted)
저장 조건: Keep in dark place,Sealed in dry,Room Temperature
산도 계수 (pKa): 9.66 · 9.66±0.18(Predicted)
물리적 상태: 가루
색상: 흰색에서 밝은 갈색까지
InChI: InChI=1S/C12H11NO/c13-11-8-10(6-7-12(11)14)9-4-2-1-3-5-9/h1-8,14H,13H2
InChIKey: IGIDZGNPFWGICD-UHFFFAOYSA-N
SMILES: C1(C2=CC=CC=C2)=CC=C(O)C(N)=C1
EPA: 1 · [1,1'-Biphenyl]-4-ol, 3-amino- (1134-36-7)

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H312 (95.3%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (97.7%): 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, P317, 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 43 reports by companies from 6 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

Hazard Classes and CategoriesAcute Tox. 4 (95.3%)；Skin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (97.7%)

안전 데이터

wgk: 2
tsca: TSCA listed
rtecs: DV6037500
HS 번호: 2922290090
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-36
Hazard Classifications: Acute Tox. 4 DermalEye Irrit. 2Skin Irrit. 2STOT SE 3
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

용도 및 제조

General Manufacturing Information[1,1'-Biphenyl]-4-ol, 3-amino-: ACTIVE

응용 분야 · 2건

용도2-Amino-4-phenylphenol is suitable as an internal standard to investigate the enzymatic activity of N-hydroxy-N-2-fluorenylacetamide (N-OH-2-FAA), a mammary gland carcinogen in the female Sprague-Dawley rat, by HPLC. It may be used as a chelating agent for metal ions.

일반 설명2-Amino-4-phenylphenol is an aminoalcohol derivative. It participates in the synthesis of bisbenzoxazoles.