4-메톡시벤질아민

4-Methoxybenzylamine

HCID 75452CAS 2393-23-9

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: COc1ccc(CN)cc1
InChIKey: IDPURXSQCKYKIJ-UHFFFAOYSA-N
분자식: C8H11NO
평균 분자량: 137.18 g/mol
단동위원소 질량: 137.08406397

이름 및 식별자

우선 이름: 4-Methoxybenzylamine
IUPAC: (4-methoxyphenyl)methanamine
현지명: 4-메톡시벤질아민
영어명: 4-Methoxybenzylamine
분자식: C8H11NO
분자량: 137.18

이름 및 동의어

4-Methoxybenzylamine2393-23-9p-MethoxybenzylamineAnisylamineBenzenemethanamine, 4-methoxy-2M6QLM4NWENSC-9269DTXSID2062371RefChem:99632DTXCID1036967219-247-2(4-Methoxyphenyl)methanamine

이름 더 보기

4-메톡시벤질아민pmbnh24MBAPara Methoxy Benzyl AmineNSC 9269forSparfloxacine

1-(4-methoxyphenyl)methanamine4-Methoxy-benzylamine4-MethoxybenzenemethanamineBenzylamine, p-methoxy-MFCD00008122para-methoxybenzylamine(4-methoxyphenyl)methylaminep-methoxy benzylamine

데이터베이스 식별자

CAS: 2393-23-9
PubChem CID: 75452
DTXSID: DTXSID2062371
ChEMBL: CHEMBL12720
ChEBI: CHEBI:49837
UNII: 2M6QLM4NWE
Nikkaji: J101.237A

물성

구조 계산 물성

XLogP: 0.8
극성 표면적: 35.3 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 2
무거운 원자 수: 10
형식 전하: 0
복잡도: 87

실험 및 물리화학적 성질

Physical DescriptionColorless liquid with an amine-like odor; [Alfa Aesar MSDS]

Kovats Retention Index1232.6

물리화학적 성질

녹는점: -10 °C · -10°C
끓는 점: 236 · 236-237 °C (lit.)
밀도: 1.05 g/mL · 1.05 g/mL at 25 °C (lit.)
증기압: 26.67 Pa · 26.67Pa at 50℃
굴절률: 20 · n20/D 1.546(lit.)
인화점: 230 °F · >230 °F
저장 조건: 2 · Keep in dark place,Inert atmosphere,2-8°C
용해도: 클로로포름, 메탄올에 용해됨
물리적 상태: 액체
산도 계수 (pKa): 9.3 · 9.30±0.10(Predicted)
Specific Gravity: 1.05 · 1.050
색상: 무색투명~미황색
수용성: 물에 잘 녹는다.
BRN: 508206 · 508206
LogP: 1.15 at · 1.15 at 25℃
NIST: 4 · Benzenemethanamine, 4-methoxy-(2393-23-9)
EPA: 4 · Benzenemethanamine, 4-methoxy- (2393-23-9)

화학적 성질

clear colorless to slightly yellow liqui

안전 및 규제

유해성 정보

Regulatory Information4-Methoxybenzylamine: Does not have an individual approval but may be used under an appropriate group standard

Hazards SummaryCauses burns; Inhalation may cause corrosive injuries to upper respiratory tract and lungs; Toxic by ingestion; [Alfa Aesar MSDS] See Benzylamine.

독성 정보

Adverse EffectsDermatotoxin - Skin burns.；Toxic Pneumonitis - Inflammation of the lungs induced by inhalation of metal fumes or toxic gases and vapors.

규제 정보

Regulatory Information4-Methoxybenzylamine: Does not have an individual approval but may be used under an appropriate group standard

안전 데이터

wgk: 3
tsca: TSCA listed
ridadr: UN 2735 8/PG 2
HS 번호: 29222900
risk_code: 34-37-22
hazard_code: C
safety_code: 26-36/37/39-45-27
포장분류: III
위험 등급: 8
기존화학 물질: KE-23228
위험 참고 사항: Corrosive

화학 및 산업

용도 및 제조

General Manufacturing InformationBenzenemethanamine, 4-methoxy-: ACTIVE

응용 분야

용도4-Methoxybenzylamine is an important raw material and intermediate used in Organic Synthesis, Pharmaceuticals, Agrochemicals and Dyestuff. It is also used fine chemical intemediate.

상·하류 제품 정보

하류 제품

4-Methoxybenzyl isocyanate 3-Chloro-4-methoxybenzylamine hydrochloride N-(4-Methoxybenzylidene)aniline N-(2-chloropyridin-3-yl)-2-{[(4-methoxyphenyl)methyl]amino}pyridine-3-carboxamide 2-아미노-N-(4-메톡시벤질)벤즈아미드 N-(4-Methoxybenzyl)-4-(trifluoroMethyl)benzaMide, 97%2-Cyano-N-(4-methoxybenzyl)acetamide

공급사50 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

衢州润东化工有限公司0570-8789886 18892685668 · [email protected]

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

南京一化生物科技有限公司13429882898; 13429882898

爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]

추가 설명

정의ChEBI: 1-(4-methoxyphenyl)methanamine is an aralkylamino compound that is benzylamine substituted by a methoxy group at the para position. It is a primary amino compound, an aromatic ether and an aralkylamino compound.