Name: Name:4-[5-methyl-2-(propan-2-yl)phenoxy]-3-nitrobenzaldehyde
Brand: Angene
SKU: AG00IA6V
Rating: 90 (10 reviews)

4-[5-methyl-2-(propan-2-yl)phenoxy]-3-nitrobenzaldehyde

CAS No.:

571153-23-6

Catalog Number:

AG00IA6V

Molecular Formula:

C17H17NO4

Molecular Weight:

299.3212

Catalog Number:

AG00IA6V

Chemical Name:

4-[5-methyl-2-(propan-2-yl)phenoxy]-3-nitrobenzaldehyde

CAS Number:

571153-23-6

Molecular Formula:

C17H17NO4

Molecular Weight:

299.3212

MDL Number:

MFCD03984491

IUPAC Name:

4-(5-methyl-2-propan-2-ylphenoxy)-3-nitrobenzaldehyde

InChI:

InChI=1S/C17H17NO4/c1-11(2)14-6-4-12(3)8-17(14)22-16-7-5-13(10-19)9-15(16)18(20)21/h4-11H,1-3H3

InChI Key:

PRRGXOYMRFGKCH-UHFFFAOYSA-N

SMILES:

O=Cc1ccc(c(c1)[N+](=O)[O-])Oc1cc(C)ccc1C(C)C

Complexity:

393

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

299.116g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

299.326g/mol

Monoisotopic Mass:

299.116g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

72.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.2