N-(Diphenylmethylene)glycine tert-butyl ester

HCID 688171CAS 81477-94-3

기본 정보

표준 SMILES
CC(C)(C)OC(=O)CN=C(c1ccccc1)c1ccccc1
InChIKey
YSHDPXQDVKNPKA-UHFFFAOYSA-N
분자식
C19H21NO2
평균 분자량
295.4 g/mol
단동위원소 질량
295.15722891

이름 및 식별자

우선 이름
N-(Diphenylmethylene)glycine tert-butyl ester
IUPAC
tert-butyl 2-(benzhydrylideneamino)acetate
영어명
N-(Diphenylmethylene)glycerine tert-butyl ester
분자식
C19H21NO2
분자량
295.38

이름 및 동의어

N-(Diphenylmethylene)glycine tert-butyl esterRefChem:828464805-438-381477-94-3tert-Butyl 2-((diphenylmethylene)amino)acetateDiphenylmethylene-Glycine t-butyl estertert-butyl 2-(benzhydrylideneamino)acetatetert-butyl 2-(diphenylmethyleneamino)acetateMFCD00134280N-(diphenylmethylene)glycine t-butyl esterN-(Diphenylmethylene)glycine, t-Butyl EsterN-(Diphenylmethylene)glycerine tert-butyl ester
이름 더 보기
AURORA KA-6707ycine tert-ButyLBP-GLY-OTBU SCHIFF BASE(C6H5)2C=NCH2CO2C(CH3)3N-(Diphenylmethylene)glycinetert-butyl 2-((diphenylmethyleETHYL (N-DIPHENYMETHYLENE)GLYCINATE
tert-butyl N-(diphenylmethylidene)glycinatetert-butyl [(diphenylmethylene)amino]acetateDPM-Gly-OtBu(Diphenylmethyleneamino)acetic Acid tert-Butyl Estertert-butyl 2-[(diphenylmethylidene)amino]acetateGlycine, N-(diphenylmethylene)-, 1,1-dimethylethyl estertert-Butyl (Diphenylmethyleneamino)acetateDIPHENYLMETHYLENE GLYCINE T-BUTYL ESTER

데이터베이스 식별자

CAS
81477-94-3
PubChem CID
688171
DTXSID
DTXSID00350810
EC Number
805-438-3
Nikkaji
J534.082I

물성

구조 계산 물성

XLogP
4.4
극성 표면적
38.7 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
3
회전 가능 결합 수
6
무거운 원자 수
22

물리화학적 성질

녹는점
51 · 51-53 °C(lit.)
끓는 점
377.5 · 377.5±34.0 °C(Predicted)
밀도
1 · 1.00±0.1 g/cm3(Predicted)
저장 조건
Sealed in dry,Room Temperature
용해도
클로로포름(약간 용해됨), 메탄올(약간 용해됨)
산도 계수 (pKa)
2.31 · 2.31±0.50(Predicted)

화학적 성질

White Solid

안전 및 규제

GHS 분류

GHS Classification · 6건

This chemical does not meet GHS hazard criteria for 50% (1 of 2) of reports.

Warning

H315 (50%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (50%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (50%): 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, 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 2 reports by companies from 2 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 2 reports by companies.;There is 1 notification provided by 1 of 2 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

Hazard Classes and CategoriesSkin Irrit. 2 (50%);Eye Irrit. 2A (50%);STOT SE 3 (50%)

안전 데이터

wgk
3
tsca
No
HS 번호
29163990
risk_code
36/37/38
safety_code
22-24/25
F 고인화성물질
10-21

화학 및 산업

응용 분야

용도suzuki reaction

공급사50 곳

国药集团化学试剂有限公司86-21-63210123 · [email protected]
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]
合肥翰刚医药科技有限公司+8618062405514 · [email protected]
INTATRADE GmbH+49 3493/605464 · [email protected]

관련 반응

55건

연결된 노트

불러오는 중…