3-[2-chloranyl-5-(2,2-dimethylpropyl)phenoxy]propan-1-ol

Systemtic Name: 3-[2-chloranyl-5-(2,2-dimethylpropyl)phenoxy]propan-1-ol Openeye Name: 3-[2-chloro-5-(2,2-dimethylpropyl)phenoxy]propan-1-ol CAS Name: 3-[2-chloro-5-(2,2-dimethylpropyl)phenoxy]-1-propanol IUPAC Name: 3-[2-chloro-5-(2,2-dimethylpropyl)phenoxy]propan-1-ol Traditional Name: 3-(2-chloro-5-neopentyl-phenoxy)propan-1-ol Formula: C14H21ClO2 MolecularWeight: 256.76834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC1=CC(=C(C=C1)Cl)OCCCO

Isomeric SMILES

CC(C)(C)CC1=CC(=C(C=C1)Cl)OCCCO

InChI

InChI=1S/C14H21ClO2/c1-14(2,3)10-11-5-6-12(15)13(9-11)17-8-4-7-16/h5-6,9,16H,4,7-8,10H2,1-3H3