Name: Name:tert-butyl 3-(4H-1,2,4-triazol-3-yl)morpholine-4-carboxylate
Brand: Angene
SKU: AG01B8Q5
Rating: 90 (10 reviews)

tert-butyl 3-(4H-1,2,4-triazol-3-yl)morpholine-4-carboxylate

CAS No.:

1803606-49-6

Catalog Number:

AG01B8Q5

Molecular Formula:

C11H18N4O3

Molecular Weight:

254.2856

Catalog Number:

AG01B8Q5

Chemical Name:

tert-butyl 3-(4H-1,2,4-triazol-3-yl)morpholine-4-carboxylate

CAS Number:

1803606-49-6

Molecular Formula:

C11H18N4O3

Molecular Weight:

254.2856

MDL Number:

MFCD28383752

IUPAC Name:

tert-butyl 3-(1H-1,2,4-triazol-5-yl)morpholine-4-carboxylate

InChI:

InChI=1S/C11H18N4O3/c1-11(2,3)18-10(16)15-4-5-17-6-8(15)9-12-7-13-14-9/h7-8H,4-6H2,1-3H3,(H,12,13,14)

InChI Key:

XWLJWBBSPUZQAK-UHFFFAOYSA-N

SMILES:

O=C(N1CCOCC1c1nnc[nH]1)OC(C)(C)C

Complexity:

305

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

254.138g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

254.29g/mol

Monoisotopic Mass:

254.138g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

80.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.4