Name: Name:2,2-dimethyl-3-(4-nitrophenyl)cyclobutan-1-one
Brand: Angene
SKU: AG01C4S9
Rating: 90 (10 reviews)

2,2-dimethyl-3-(4-nitrophenyl)cyclobutan-1-one

CAS No.:

1271911-39-7

Catalog Number:

AG01C4S9

Molecular Formula:

C12H13NO3

Molecular Weight:

219.2365

Catalog Number:

AG01C4S9

Chemical Name:

2,2-dimethyl-3-(4-nitrophenyl)cyclobutan-1-one

CAS Number:

1271911-39-7

Molecular Formula:

C12H13NO3

Molecular Weight:

219.2365

MDL Number:

MFCD24103088

IUPAC Name:

2,2-dimethyl-3-(4-nitrophenyl)cyclobutan-1-one

InChI:

InChI=1S/C12H13NO3/c1-12(2)10(7-11(12)14)8-3-5-9(6-4-8)13(15)16/h3-6,10H,7H2,1-2H3

InChI Key:

LQWDJSRFXLJIAC-UHFFFAOYSA-N

SMILES:

O=C1CC(C1(C)C)c1ccc(cc1)[N+](=O)[O-]

Complexity:

311

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

219.09g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

219.24g/mol

Monoisotopic Mass:

219.09g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

62.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.2