Name: Name:P-DECYLOXYNITROBENZENE
Brand: Angene
SKU: AG00C7H5
Rating: 90 (10 reviews)

P-DECYLOXYNITROBENZENE

CAS No.:

31657-37-1

Catalog Number:

AG00C7H5

Molecular Formula:

C16H25NO3

Molecular Weight:

279.3746

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Product Description

Catalog Number:

AG00C7H5

Chemical Name:

P-DECYLOXYNITROBENZENE

CAS Number:

31657-37-1

Molecular Formula:

C16H25NO3

Molecular Weight:

279.3746

MDL Number:

MFCD00024674

IUPAC Name:

1-decoxy-4-nitrobenzene

InChI:

InChI=1S/C16H25NO3/c1-2-3-4-5-6-7-8-9-14-20-16-12-10-15(11-13-16)17(18)19/h10-13H,2-9,14H2,1H3

InChI Key:

FQIOGTJBANMZNX-UHFFFAOYSA-N

SMILES:

CCCCCCCCCCOc1ccc(cc1)[N+](=O)[O-]

Properties

Complexity:

245

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

279.183g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

279.38g/mol

Monoisotopic Mass:

279.183g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

6.4

Literature

Title	Journal
1-Dodec-yloxy-4-nitro-benzene.	Acta crystallographica. Section E, Structure reports online 20091201
1-Dec-yloxy-4-nitro-benzene.	Acta crystallographica. Section E, Structure reports online 20091101