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Methyl 1-tritylaziridine-2-carboxylate

Methyl 1-tritylaziridine-2-carboxylate - CAS 76357-18-1

Name: Methyl 1-tritylaziridine-2-carboxylate
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB054099
Product Name:	Methyl 1-tritylaziridine-2-carboxylate
CAS:	76357-18-1
Synonyms:	Methyl 1-(Triphenylmethyl)-2-aziridinecarboxylate; 1-Tritylaziridine-2-carboxylic acid methyl ester; methyl (2R)-1-(triphenylmethyl)aziridine-2-carboxylate

Technical Data

Safety and Hazards

Computed Properties

IUPAC Name:	methyl 1-tritylaziridine-2-carboxylate
Molecular Weight:	343.41
Molecular Formula:	C23H21NO2
Canonical SMILES:	COC(=O)C1CN1C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4
InChI:	InChI=1S/C23H21NO2/c1-26-22(25)21-17-24(21)23(18-11-5-2-6-12-18,19-13-7-3-8-14-19)20-15-9-4-10-16-20/h2-16,21H,17H2,1H3
InChI Key:	QGSITPKXYQEFIR-UHFFFAOYSA-N
Boiling Point:	430.3±45.0 °C at 760 mmHg
Melting Point:	132°C
Purity:	>98.0%(N)
Density:	1.195±0.06 g/cm3

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Related Functional Groups

Arenes

[2091593-59-6]C9H10F3NO
3-methoxy-6-methyl-2-(trifluoromethyl)aniline
[15522-59-5]C40H56BN
Tetrabutylammonium tetraphenylborate
[52159-67-8]C8H7ClO3
Methyl 3-chloro-2-hydroxybenzoate
[605-02-7]C16H12
1-Phenylnaphthalene
[127107-31-7]C9H10ClN3
1-Phenyl-1H-pyrazol-4-amine hydrochloride
[81574-05-2]C11H13N3
N-Benzyl-1-methyl-1H-pyrazol-3-amine

Carbonyl Compounds

[89908-23-6]C23H22N2O5
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[17746-05-3]C11H21ClO
Undecanoyl chloride
[70199-62-1]C8H10ClNO
(4-Pyridyl)acetone Hydrochloride
[1018141-88-2]C17H14N4O2
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
[55441-25-3]C8H7N3O
1-(2-Cyanophenyl)urea
[1035840-45-9]C14H16N2O4
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid

Oxygen Compounds

[5333-45-9]C10H14O4
1,2,3,5-Tetramethoxybenzene
[1170836-25-5]C8H11N3O2
1-Cyclopentyl-5-nitro-1H-pyrazole
[1011396-69-2]C12H17F2NO2
2,2-Difluoro-N-(4-methoxy-3-(methoxymethyl)benzyl)ethanamine
[5724-76-5]C7H9NO4
3-(2,5-Dioxopyrrolidin-1-yl)propionic acid
[861434-97-1]C13H11ClN2O3
3-(2-Chloro-6-methylphenoxy)-5-nitroaniline
[2091593-59-6]C9H10F3NO
3-methoxy-6-methyl-2-(trifluoromethyl)aniline

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): 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]
Precautionary Statement:	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
Signal Word:	Warning

Complexity:	427
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	343.157228913
Formal Charge:	0
Heavy Atom Count:	26
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	343.157228913
Rotatable Bond Count:	6
Topological Polar Surface Area:	29.3
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	4.7