N-(1,1-Dimethylethyl)benzenemethanamine (HCID 76908)

개요

structure in first source

이름 및 식별자

우선 이름: N-(1,1-Dimethylethyl)benzenemethanamine
IUPAC: N-benzyl-2-methylpropan-2-amine
현지명: 부틸벤질아민
영어명: N-(tert-Butyl)benzylamine
분자식: C11H17N
분자량: 163.26

이름 및 동의어

3378-72-1Benzenemethanamine, N-(1,1-dimethylethyl)-N-(1,1-dimethylethyl)benzenemethanamineN-(1,1-Dimethylethyl)benzylamineQMD9L6C8U3DTXSID2063002N-(tert-Butyl)benzenemethanamineNBTBA cpdRefChem:823305DTXCID1038747222-179-6N-benzylidene-tert-butylamine

이름 더 보기

부틸벤질아민N-(tert-뷰틸)벤질아민N-(tert-부틸)벤질아민AI3-23247AKOS BC-1243N-BenzylisobutylamineN-BENZYL-T-BUTYLAMINEElobixibat Impurity 5TERT-BUTYL-BENZYLAMINEbenzyl-tert-butyl-amine

N-(tert-Butyl)benzylamineN-benzyl-2-methylpropan-2-amineN-Benzyl-tert-butylamineN-tert-ButylbenzylamineBenzyl(tert-butyl)aminetert-ButylbenzylamineN-t-ButylbenzylamineMFCD00008798

데이터베이스 식별자

CAS: 3378-72-1
PubChem CID: 76908
DTXSID: DTXSID2063002
ChEMBL: CHEMBL5430961
UNII: QMD9L6C8U3
EC Number: 222-179-6
Nikkaji: J150.015E

물성

구조 계산 물성

XLogP: 2.5
극성 표면적: 12 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 1
회전 가능 결합 수: 3
무거운 원자 수: 12
형식 전하: 0
복잡도: 117

실험 및 물리화학적 성질

SpringerMaterials PropertiesOptical coefficient

물리화학적 성질

녹는점: -25 °C · -25 °C
끓는 점: 80 °C5 · 80 °C5 mm Hg(lit.)
밀도: 0.881 g/mL · 0.881 g/mL at 25 °C(lit.)
증기압: 12.1 Pa · 12.1Pa at 25℃
굴절률: 20 · n20/D 1.497(lit.)
인화점: 176 °F · 176 °F
저장 조건: 30 °C · Store below +30°C.
용해도: 2 g/L · 2g/L
산도 계수 (pKa): 9.77 · 9.77±0.29(Predicted)
물리적 상태: 기름
색상: 무색
수용성: 2 g/L · 2g/L(20℃)
BRN: 507464 · 507464
Dielectric constant: 3.24 · 3.2400000000000002
InChI: 1S/C11H17N/c1-11(2,3)12-9-10-7-5-4-6-8-10/h4-8,12H,9H2,1-3H3/p+1
InChIKey: DLSOILHAKCBARI-UHFFFAOYSA-N
SMILES: [N+H2](C(C)(C)C)Cc1ccccc1
LogP: 2.9 at · 2.9 at 25℃
NIST: Benzenemethanamine, N-(1,1-dimethylethyl)-(3378-72-1)
EPA: Benzenemethanamine, N-(1,1-dimethylethyl)- (3378-72-1)

화학적 성질

CLEAR COLOURLESS TO PALE YELLOW LIQUID

안전 및 규제

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 4% (1 of 25) of reports.

Danger

H226 (16%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P260, P264, P270, P280, P301+P317, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P321, P330, P363, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 25 reports by companies from 12 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 2건

Status: Active Update: 11-12-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/22706

Benzenemethanamine, N-(1,1-dimethylethyl)-: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesFlam. Liq. 3 (16%)

안전 데이터

wgk: 3
tsca: TSCA listed
ridadr: 2735
HS 번호: 29214980
risk_code: 34-22-36/37/38
hazard_code: C,Xi
safety_code: 23-24/25-36-26-45-36/37/39
포장분류: III
위험 등급: 8
Hazard Classifications: Acute Tox. 4 OralEye Dam. 1Skin Corr. 1B
스토리지 클래스: 8A - Combustible, corrosive hazardous materials

화학 및 산업

용도 및 제조

General Manufacturing InformationBenzenemethanamine, N-(1,1-dimethylethyl)-: ACTIVE

응용 분야

용도N-Benzyl-tert-butylamine, is used as a protected amine. It aids in the oxidation to the corresponding hydroxylamine and nitrone.

상·하류 제품 정보

상류 원료

하류 제품

테브펜피라드 4-아세틸옥시-3-아세틸옥시메틸-(N-벤질-N-tert부틸아미노)아세토페논염산염

공급사50 곳

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

Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]

温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]

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

Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]

연결된 노트

불러오는 중…

부틸벤질아민

기본 정보

개요