Name: Name:(E)-4-(tert-Butoxy)-4-oxobut-2-enoic acid
Brand: Angene
SKU: AG003ABR
Rating: 90 (10 reviews)

(E)-4-(tert-Butoxy)-4-oxobut-2-enoic acid

CAS No.:

135355-96-3

Catalog Number:

AG003ABR

Molecular Formula:

C8H12O4

Molecular Weight:

172.1785

Catalog Number:

AG003ABR

Chemical Name:

(E)-4-(tert-Butoxy)-4-oxobut-2-enoic acid

CAS Number:

135355-96-3

Molecular Formula:

C8H12O4

Molecular Weight:

172.1785

MDL Number:

MFCD08669525

IUPAC Name:

(E)-4-[(2-methylpropan-2-yl)oxy]-4-oxobut-2-enoic acid

InChI:

InChI=1S/C8H12O4/c1-8(2,3)12-7(11)5-4-6(9)10/h4-5H,1-3H3,(H,9,10)/b5-4+

InChI Key:

BAXKSCVINAKVNE-SNAWJCMRSA-N

SMILES:

O=C(OC(C)(C)C)/C=C/C(=O)O

Complexity:

210

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

172.074g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

172.18g/mol

Monoisotopic Mass:

172.074g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

63.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.9