Name: Name:6-Nitro-3,4-dihydro-2H-quinoline-1-carboxylic acid tert-butyl ester
Brand: Angene
SKU: AG009W97
Rating: 90 (10 reviews)

6-Nitro-3,4-dihydro-2H-quinoline-1-carboxylic acid tert-butyl ester

CAS No.:

1368715-58-5

Catalog Number:

AG009W97

Molecular Formula:

C14H18N2O4

Molecular Weight:

278.3037

Catalog Number:

AG009W97

Chemical Name:

6-Nitro-3,4-dihydro-2H-quinoline-1-carboxylic acid tert-butyl ester

CAS Number:

1368715-58-5

Molecular Formula:

C14H18N2O4

Molecular Weight:

278.3037

MDL Number:

MFCD21983891

IUPAC Name:

tert-butyl 6-nitro-3,4-dihydro-2H-quinoline-1-carboxylate

InChI:

InChI=1S/C14H18N2O4/c1-14(2,3)20-13(17)15-8-4-5-10-9-11(16(18)19)6-7-12(10)15/h6-7,9H,4-5,8H2,1-3H3

InChI Key:

BWPXNUSEUAMUOF-UHFFFAOYSA-N

SMILES:

O=C(N1CCCc2c1ccc(c2)[N+](=O)[O-])OC(C)(C)C

Complexity:

386

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

278.127g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

278.308g/mol

Monoisotopic Mass:

278.127g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

75.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.9