Name: Name:tert-butyl 2-(1H-pyrazol-3-yl)acetate
Brand: Angene
SKU: AG01B4D4
Rating: 90 (10 reviews)

tert-butyl 2-(1H-pyrazol-3-yl)acetate

CAS No.:

1503584-81-3

Catalog Number:

AG01B4D4

Molecular Formula:

C9H14N2O2

Molecular Weight:

182.2197

Catalog Number:

AG01B4D4

Chemical Name:

tert-butyl 2-(1H-pyrazol-3-yl)acetate

CAS Number:

1503584-81-3

Molecular Formula:

C9H14N2O2

Molecular Weight:

182.2197

MDL Number:

MFCD21808247

IUPAC Name:

tert-butyl 2-(1H-pyrazol-5-yl)acetate

InChI:

InChI=1S/C9H14N2O2/c1-9(2,3)13-8(12)6-7-4-5-10-11-7/h4-5H,6H2,1-3H3,(H,10,11)

InChI Key:

CSWCANWQEWYHNN-UHFFFAOYSA-N

SMILES:

O=C(Cc1cc[nH]n1)OC(C)(C)C

Complexity:

187

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

182.106g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

182.223g/mol

Monoisotopic Mass:

182.106g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3: