Name: Name:Rel-(1r,4r)-4-{[(2-nitrophenyl)methyl]amino}cyclohexan-1-ol, trans
Brand: Angene
SKU: AG01C4V1
Rating: 90 (10 reviews)

Rel-(1r,4r)-4-{[(2-nitrophenyl)methyl]amino}cyclohexan-1-ol, trans

CAS No.:

223932-34-1

Catalog Number:

AG01C4V1

Molecular Formula:

C13H18N2O3

Molecular Weight:

250.2936

Catalog Number:

AG01C4V1

Chemical Name:

Rel-(1r,4r)-4-{[(2-nitrophenyl)methyl]amino}cyclohexan-1-ol, trans

CAS Number:

223932-34-1

Molecular Formula:

C13H18N2O3

Molecular Weight:

250.2936

MDL Number:

MFCD29763219

IUPAC Name:

4-[(2-nitrophenyl)methylamino]cyclohexan-1-ol

InChI:

InChI=1S/C13H18N2O3/c16-12-7-5-11(6-8-12)14-9-10-3-1-2-4-13(10)15(17)18/h1-4,11-12,14,16H,5-9H2

InChI Key:

DELTZHFOMFJNKL-UHFFFAOYSA-N

SMILES:

O[C@@H]1CC[C@H](CC1)NCc1ccccc1[N+](=O)[O-]

Complexity:

272

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

250.132g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

250.298g/mol

Monoisotopic Mass:

250.132g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

78.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.1