Name: Name:4-phenylazepan-4-ol oxalic acid
Brand: Angene
SKU: AG01BFJJ
Rating: 90 (10 reviews)

4-phenylazepan-4-ol oxalic acid

CAS No.:

1803600-14-7

Catalog Number:

AG01BFJJ

Molecular Formula:

C14H19NO5

Molecular Weight:

281.3044

Catalog Number:

AG01BFJJ

Chemical Name:

4-phenylazepan-4-ol oxalic acid

CAS Number:

1803600-14-7

Molecular Formula:

C14H19NO5

Molecular Weight:

281.3044

MDL Number:

MFCD28118619

IUPAC Name:

oxalic acid;4-phenylazepan-4-ol

InChI:

InChI=1S/C12H17NO.C2H2O4/c14-12(7-4-9-13-10-8-12)11-5-2-1-3-6-11;3-1(4)2(5)6/h1-3,5-6,13-14H,4,7-10H2;(H,3,4)(H,5,6)

InChI Key:

WQXYRSLAXYFPRI-UHFFFAOYSA-N

SMILES:

OC1(CCNCCC1)c1ccccc1.OC(=O)C(=O)O

Complexity:

249

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

281.126g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

281.308g/mol

Monoisotopic Mass:

281.126g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

107A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: