Name: Name:1-Piperidinecarboxylic acid, 4-(4-forMyl-1H-1,2,3-triazol-1-yl)-, 1,1-diMethylethyl ester
Brand: Angene
SKU: AG00GTYQ
Rating: 90 (10 reviews)

1-Piperidinecarboxylic acid, 4-(4-forMyl-1H-1,2,3-triazol-1-yl)-, 1,1-diMethylethyl ester

CAS No.:

915370-15-9

Catalog Number:

AG00GTYQ

Molecular Formula:

C13H20N4O3

Molecular Weight:

280.3229

Catalog Number:

AG00GTYQ

Chemical Name:

1-Piperidinecarboxylic acid, 4-(4-forMyl-1H-1,2,3-triazol-1-yl)-, 1,1-diMethylethyl ester

CAS Number:

915370-15-9

Molecular Formula:

C13H20N4O3

Molecular Weight:

280.3229

MDL Number:

MFCD13184698

IUPAC Name:

tert-butyl 4-(4-formyltriazol-1-yl)piperidine-1-carboxylate

InChI:

InChI=1S/C13H20N4O3/c1-13(2,3)20-12(19)16-6-4-11(5-7-16)17-8-10(9-18)14-15-17/h8-9,11H,4-7H2,1-3H3

InChI Key:

FHKWIQQVFYABSA-UHFFFAOYSA-N

SMILES:

O=Cc1nnn(c1)C1CCN(CC1)C(=O)OC(C)(C)C

Complexity:

361

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

280.154g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

280.328g/mol

Monoisotopic Mass:

280.154g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

77.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.8