Name: Name:tert-butyl 2-[4-(hydroxymethyl)-1H-1,2,3-triazol-1-yl]acetate
Brand: Angene
SKU: AG019ZRO
Rating: 90 (10 reviews)

tert-butyl 2-[4-(hydroxymethyl)-1H-1,2,3-triazol-1-yl]acetate

CAS No.:

1394041-94-1

Catalog Number:

AG019ZRO

Molecular Formula:

C9H15N3O3

Molecular Weight:

213.2337

Catalog Number:

AG019ZRO

Chemical Name:

tert-butyl 2-[4-(hydroxymethyl)-1H-1,2,3-triazol-1-yl]acetate

CAS Number:

1394041-94-1

Molecular Formula:

C9H15N3O3

Molecular Weight:

213.2337

MDL Number:

MFCD22375320

IUPAC Name:

tert-butyl 2-[4-(hydroxymethyl)triazol-1-yl]acetate

InChI:

InChI=1S/C9H15N3O3/c1-9(2,3)15-8(14)5-12-4-7(6-13)10-11-12/h4,13H,5-6H2,1-3H3

InChI Key:

ZIKQEFBJVMVLHP-UHFFFAOYSA-N

SMILES:

OCc1nnn(c1)CC(=O)OC(C)(C)C

Complexity:

227

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

213.111g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

213.237g/mol

Monoisotopic Mass:

213.111g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

77.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.2