O-Methyltyramine (HCID 4657)

이름 및 식별자

우선 이름: O-Methyltyramine
IUPAC: 2-(4-methoxyphenyl)ethanamine
현지명: 메톡시페닐에틸아민
영어명: 4-Methoxyphenethylamine
분자식: C9H13NO
분자량: 151.21

이름 및 동의어

4-Methoxyphenethylamine55-81-2Homoanisylaminep-Methoxyphenethylamine4-Methoxybenzeneethanamine4-MethoxyphenylethylamineO-MethyltyramineBenzeneethanamine, 4-methoxy-P-METHOXYPHENYLETHYLAMINE2-(4-Methoxyphenyl)Ethan-1-AmineTyramine, O-methyl-USAF EL-52

이름 더 보기

메톡시페닐에틸아민4-메톡시펜에틸아민2-(4-Methoxyphenyl)ethanamineMethyl Tyramine2-(4-METHOXYPHENYL)ETHYLAMINE4-MPEAusafel-52RARECHEM AL BW 0058

PHENETHYLAMINE, p-METHOXY-NSC 43687EINECS 200-245-5BRN 0508967DTXSID6058764NSC-436872-(4-methoxyphenyl)-ethylamineCHEBI:266039

데이터베이스 식별자

CAS: 2045-79-6、55-81-2
PubChem CID: 4657
DTXSID: DTXSID6058764
ChEMBL: CHEMBL101036
ChEBI: CHEBI:266039
UNII: UCE8P23XWF
EC Number: 200-245-5、218-066-6
Nikkaji: J74.924I

물성

구조 계산 물성

XLogP: 1.6
극성 표면적: 35.3 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 3
무거운 원자 수: 11
형식 전하: 0
복잡도: 97

실험 및 물리화학적 성질

Kovats Retention Index1318.8；1335.7

물리화학적 성질

녹는점: 249 · 249-251°C
끓는 점: 138 · 138-140 °C20 mm Hg(lit.)
밀도: 1.031 g/mL · 1.031 g/mL at 20 °C(lit.)
굴절률: 20 · n20/D 1.538(lit.)
인화점: 230 °F · >230 °F
저장 조건: 2 · 2-8°C
용해도: 클로로포름(소량으로 용해), 메탄올(약간 용해됨)
산도 계수 (pKa): 9.96 · 9.96±0.10(Predicted)
물리적 상태: 액체
색상: 연노랑
BRN: 508967 · 508967
InChI: InChI=1S/C9H13NO/c1-11-9-4-2-8(3-5-9)6-7-10/h2-5H,6-7,10H2,1H3
InChIKey: LTPVSOCPYWDIFU-UHFFFAOYSA-N
SMILES: C1(CCN)=CC=C(OC)C=C1
NIST: 4 · Benzeneethanamine, 4-methoxy-(55-81-2)
EPA: 4 · Benzeneethanamine, 4-methoxy- (55-81-2)

화학적 성질

clear colorless to slightly yellow liquid

안전 및 규제

GHS 분류

GHS Classification · 6건

This chemical does not meet GHS hazard criteria for 0.9% (1 of 106) of reports.

Danger

H314 (99.1%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H318 (38.7%): Causes serious eye damage [Danger Serious eye damage/eye irritation]

P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 106 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Reported as not meeting GHS hazard criteria per 1 of 106 reports by companies.；There are 3 notifications provided by 105 of 106 reports by companies with hazard statement code(s).；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

Status: Active Update: 30-10-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/27340

2-(4-Methoxyphenyl)-ethylamine: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and Categories · 2건

Skin Corr. 1C (99.1%)；Eye Dam. 1 (38.7%)

Skin Corr. 1B (100%)

규제 정보

Regulatory Information · 2건

Status: Active Update: 30-10-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/27340

2-(4-Methoxyphenyl)-ethylamine: Does not have an individual approval but may be used under an appropriate group standard

안전 데이터

wgk: 3
tsca: TSCA listed
rtecs: SH7875000
ridadr: UN 2735 8/PG 3
HS 번호: 29222900
risk_code: 34
hazard_code: C,T
safety_code: 26-36/37/39-45-27
포장분류: II
위험 등급: 8
F 고인화성물질: 10-23
위험 참고 사항: Toxic/Corrosive
Hazard Classifications: Skin Corr. 1B
스토리지 클래스: 8A - Combustible corrosive hazardous materials

화학 및 산업

용도 및 제조

General Manufacturing InformationBenzeneethanamine, 4-methoxy-: ACTIVE

응용 분야

용도4-Methoxyphenethylamine an inhibitor of the deamination of tyramine and tryptamine. It is intermediates of ritodrine. ritodrine is an adrenergic β2 receptor agonists used to prevent premature birth.

일반 설명4-Methoxyphenethylamine inhibits the monoamine oxidase-catalyzed deamination of both tyramine and tryptamine.

상·하류 제품 정보

상류 원료

3-(4-메톡시페닐)프로피온아미드 1-(2-azidoethyl)-4-methoxy-benzene 1-Methoxy-4-(2-nitroethyl)benzene 1-(4-Methoxyphenyl)-2-nitroethylene 4-Methoxystyrene 4-Methoxyphenethyl alcohol (4-메톡시페닐)아세토나이트릴

하류 제품

4-Methoxyphenethyl bromide N,N-디메틸-4-메톡시페닐에틸아민 4-Methoxy-N-(phenylmethylene)benzeneethanamine 2-시아노-N-[2-(4-메톡시페닐)에틸]아세트아미드 Benzenesulfonamide, 5-(2-aminoethyl)-2-methoxy-

공급사50 곳

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

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

南京凯美西化工有限公司02558748998 18951874644 · [email protected]

上海泰矶林实业有限公司02150630626 17717886015 · [email protected]

T&W GROUP021-61551611 13296011611 · [email protected]

추가 설명

정의ChEBI: 4-methoxyphenylethylamine is a primary amino compound consisting of ethylamine having a 4-methoxyphenyl substituent at the 2-position. It derives from a hydride of a 2-phenylethylamine.

연결된 노트

불러오는 중…

2-메톡시펜에틸아민

기본 정보