Name: Name:N-[1-(1H-1,2,3-Benzotriazol-1-yl)butyl]-3-nitroaniline
Brand: Angene
SKU: AG01F7Y6
Rating: 90 (10 reviews)

N-[1-(1H-1,2,3-Benzotriazol-1-yl)butyl]-3-nitroaniline

CAS No.:

129882-02-6

Catalog Number:

AG01F7Y6

Molecular Formula:

C16H17N5O2

Molecular Weight:

311.3385

Pack Size

Purity

Availability

Location

Price(USD)

Quantity

250mg

80%

1 week

United States

$260

- +

80%

1 week

United States

$482

- +

Catalog Number:

AG01F7Y6

Chemical Name:

N-[1-(1H-1,2,3-Benzotriazol-1-yl)butyl]-3-nitroaniline

CAS Number:

129882-02-6

Molecular Formula:

C16H17N5O2

Molecular Weight:

311.3385

MDL Number:

MFCD00504795

IUPAC Name:

N-[1-(benzotriazol-1-yl)butyl]-3-nitroaniline

InChI:

InChI=1S/C16H17N5O2/c1-2-6-16(17-12-7-5-8-13(11-12)21(22)23)20-15-10-4-3-9-14(15)18-19-20/h3-5,7-11,16-17H,2,6H2,1H3

InChI Key:

YBGIZBDXNVYLOS-UHFFFAOYSA-N

SMILES:

CCCC(n1nnc2c1cccc2)Nc1cccc(c1)[N+](=O)[O-]

Complexity:

402

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

311.138g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

311.345g/mol

Monoisotopic Mass:

311.138g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

88.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.2