Name: Name:2-(1-(Benzyloxy)-2-methylpropan-2-yl)-6-fluoro-5-nitro-1H-indole
Brand: Angene
SKU: AG00HZ20
Rating: 90 (10 reviews)

2-(1-(Benzyloxy)-2-methylpropan-2-yl)-6-fluoro-5-nitro-1H-indole

CAS No.:

1638771-94-4

Catalog Number:

AG00HZ20

Molecular Formula:

C19H19FN2O3

Molecular Weight:

342.3642

Catalog Number:

AG00HZ20

Chemical Name:

2-(1-(Benzyloxy)-2-methylpropan-2-yl)-6-fluoro-5-nitro-1H-indole

CAS Number:

1638771-94-4

Molecular Formula:

C19H19FN2O3

Molecular Weight:

342.3642

MDL Number:

MFCD27987736

IUPAC Name:

6-fluoro-2-(2-methyl-1-phenylmethoxypropan-2-yl)-5-nitro-1H-indole

InChI:

InChI=1S/C19H19FN2O3/c1-19(2,12-25-11-13-6-4-3-5-7-13)18-9-14-8-17(22(23)24)15(20)10-16(14)21-18/h3-10,21H,11-12H2,1-2H3

InChI Key:

QSPIMYRCLPKMBI-UHFFFAOYSA-N

SMILES:

[O-][N+](=O)c1cc2cc([nH]c2cc1F)C(COCc1ccccc1)(C)C

Complexity:

462

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

342.138g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

342.37g/mol

Monoisotopic Mass:

342.138g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

70.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.5