Name: Name:2-[4-(adamantan-1-yl)phenoxy]propanoic acid
Brand: Angene
SKU: AG019N9W
Rating: 90 (10 reviews)

2-[4-(adamantan-1-yl)phenoxy]propanoic acid

CAS No.:

52804-08-7

Catalog Number:

AG019N9W

Molecular Formula:

C19H24O3

Molecular Weight:

300.3921

Catalog Number:

AG019N9W

Chemical Name:

2-[4-(adamantan-1-yl)phenoxy]propanoic acid

CAS Number:

52804-08-7

Molecular Formula:

C19H24O3

Molecular Weight:

300.3921

MDL Number:

MFCD09043311

IUPAC Name:

2-[4-(1-adamantyl)phenoxy]propanoic acid

InChI:

InChI=1S/C19H24O3/c1-12(18(20)21)22-17-4-2-16(3-5-17)19-9-13-6-14(10-19)8-15(7-13)11-19/h2-5,12-15H,6-11H2,1H3,(H,20,21)

InChI Key:

GABFCYXGNGRLDU-UHFFFAOYSA-N

SMILES:

CC(C(=O)O)Oc1ccc(cc1)C12CC3CC(C2)CC(C1)C3

Complexity:

395

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

300.173g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

300.398g/mol

Monoisotopic Mass:

300.173g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

46.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

5.1