Name: Name:5-tert-butyl-4,5-dihydro-1,2-oxazole-3-carboxylic acid
Brand: Angene
SKU: AG01EKWQ
Rating: 90 (10 reviews)

5-tert-butyl-4,5-dihydro-1,2-oxazole-3-carboxylic acid

CAS No.:

1781171-36-5

Catalog Number:

AG01EKWQ

Molecular Formula:

C8H13NO3

Molecular Weight:

171.1937

Catalog Number:

AG01EKWQ

Chemical Name:

5-tert-butyl-4,5-dihydro-1,2-oxazole-3-carboxylic acid

CAS Number:

1781171-36-5

Molecular Formula:

C8H13NO3

Molecular Weight:

171.1937

MDL Number:

MFCD31667278

IUPAC Name:

5-tert-butyl-4,5-dihydro-1,2-oxazole-3-carboxylic acid

InChI:

InChI=1S/C8H13NO3/c1-8(2,3)6-4-5(7(10)11)9-12-6/h6H,4H2,1-3H3,(H,10,11)

InChI Key:

ODQHJSMWVIMCBG-UHFFFAOYSA-N

SMILES:

OC(=O)C1=NOC(C1)C(C)(C)C

Complexity:

227

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

171.09g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

171.196g/mol

Monoisotopic Mass:

171.09g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

58.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.6