Compound: D-Citronellol
SMILES: OCC[C@@H](CCC=C(C)C)C
InChIKey: QMVPMAAFGQKVCJ-SNVBAGLBSA-N
Synonyms: D-Citronellol, (R)-3,7-Dimethyl-6-octen-1-ol, beta-Citronellol, (R)-, (R)-beta-Citronellol, 6-Octen-1-ol, 3,7-dimethyl-, (R)-, UNII-P01OUT964K, P01OUT964K, CITRONELLOL, D-, EINECS 214-250-5, AI3-00204, DTXSID00880647, 6-Octen-1-ol, 3,7-dimethyl-, (theta)-, RefChem:54520, Hydrating Treatment Toner, Hydrating extra concentrate serum, DTXCID601022015, Purifying relief soothing gel essence, 214-250-5, 1117-61-9, (R)-Citronellol, (3R)-3,7-dimethyloct-6-en-1-ol, (R)-3,7-Dimethyloct-6-en-1-ol, (R)-(+)-beta-Citronellol, (+)-citronellol, 6-Octen-1-ol, 3,7-dimethyl-, (3R)-, (R)-(+)-Citronellol, MFCD00063215, (+)-beta-Citronellol, b-citronellol, FEMA No. 2309, (R)-(+)-.beta.-Citronellol, (R)-(+)-ss-Citronellol; (3R)-3,7-dimethyl-6-octen-1-ol, .BETA.-CITRONELLOL, (R)-, 6-Octen-1-ol,3,7-dimethyl-,(3R)-, (+)-A-Citronellol, (+)-R-Citronellol, CITRONELLOL [FCC], (r)-(+)--citronellol, CITRONELLOL [FHFI], (R)-(+)-ss-Citronellol, (R)-(+)-?-Citronellol, SCHEMBL21321, (R)-(+)-beta -Citronellol, orb1685403, (R)-3,7-dimethyl-6-octenol, (R)-(+)- beta -Citronellol, CHEMBL1907993, CHEBI:10360, 3,7-Dimethyl-6-octen-1-ol #, R-(+)-.BETA.-CITRONELLOL, (R)-(+)-beta-Citronellol, 98%, 3,7-Dimethyl-(R)-6-Octen-1-ol, 3,7-Dimethyl-(3R)-6-Octen-1-ol, AKOS028108897, D-Citronellol;(R)-(+)--Citronellol, .BETA.-CITRONELLOL, R-(+)-, EBC-616211, LMPR0102010008, NCGC00249168-01, FD157131, SY114862, (R)-(+)-3,7-dimethyl-oct-6-en-1-ol, HY-124257, CS-0086047, NS00003343, C09849, F82355, F099344, Q418813
Theoretical properties:
molecular_formula: C10H20O
molecular_weight: 156.26 g/mol
exact_mass: 156.151415257 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 1
hydrogen_bond_acceptor_count: 1
rotatable_bond_count: 5
heavy_atom_count: 11
topological_polar_surface_area: 20.2 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
boiling_point: 221.00 to 224.00 °C. @ 760.00 mm Hg
vapor_pressure: 0.02 [mmHg]
Descriptions:
pubchem: (R)-(+)-citronellol is a citronellol that is oct-6-ene substituted by a hydroxy group at position 1 and methyl groups at positions 3 and 7 (the 3R-enantiomer). It is an enantiomer of a (S)-(-)-citronellol.
chebi: A citronellol that is oct-6-ene substituted by a hydroxy group at position 1 and methyl groups at positions 3 and 7 (the 3<i>R</i>-enantiomer).
chembl: (+)-CITRONELLOL is a small molecule listed in the ChEMBL database but has not progressed to an approved clinical phase.
wikipedia: Limonene () is a colorless liquid aliphatic hydrocarbon classified as a cyclic monoterpene, and is the major component in the fragrance and essential oil of citrus fruit peels, taking its name from Italian limone ("lemon").
Limonene is a chiral molecule, and most biological sources produce just one enantiomer (isomer). The (+)-isomer, d-limonene, which is the (R)-enantiomer, occurs more commonly in nature in citrus fruit peels, the principal commercial source, from which it is obtained commercially by two primary methods: centrifugal separation and steam distillation. d-Limonene is used as a flavoring agent in food manufacturing, in chemical synthesis as a precursor to carvone, and as a renewables-based solvent in cleaning products. It has a "citrus, orange, fresh, sweet, peely" aroma.
The less common (−)-isomer, l-limonene, which is the (S)-enantiomer, has a piny, turpentine-like odour, and is found in the edible parts of such plants as caraway, dill, and bergamot orange plants.