Cas no 18951-85-4 ((R)-(+)-Citronellic Acid)

(R)-(+)-Citronellic Acid structure
(R)-(+)-Citronellic Acid structure
Product Name:(R)-(+)-Citronellic Acid
CAS No:18951-85-4
MF:C10H18O2
MW:170.248723506927
MDL:MFCD00075195
CID:123270
PubChem ID:24860819
Update Time:2025-04-18

(R)-(+)-Citronellic Acid Chemical and Physical Properties

Names and Identifiers

    • 6-Octenoic acid,3,7-dimethyl-, (3R)-
    • (R)-(+)-Citronellic acid
    • (+)-(R)-citronellic acid
    • (3R)-3,7-dimethyl-6-octenoic acid
    • (R)-(+)-3,7-Dimethyloct-6-enoic Acid
    • (R)-3,7-dimethyloct-6-enoic acid
    • 340499_ALDRICH
    • AC1OE5SI
    • CTK4E0148
    • R-(+)-citronellic acid
    • (R)-(+)-citronellic
    • 3,7-DIMETHYL-6-OCTENOIC ACID
    • [R,(+)]-3,7-Dimethyl-6-octenoic acid
    • (R)-(+)-Citronellic acid 98%
    • 6-Octenoic acid, 3,7-dimethyl-, (3R)-
    • CS-0142271
    • (r)-citronellic acid
    • EN300-7831692
    • DTXSID50426458
    • MFCD00075195
    • W19706
    • BS-42160
    • SCHEMBL712982
    • CHEBI:144576
    • 18951-85-4
    • (+)-citronellic acid
    • J-012228
    • (3R)-3,7-dimethyloct-6-enoic acid
    • AKOS025294799
    • Z1255486488
    • (R)-3,7-dimethyl-6-octenoic acid
    • (R)-(+)-Citronellic acid, 98%
    • (R)-3,7-Dimethyloct-6-enoicacid
    • (R)-3,7-Dimethyl-6-octenoate
    • (3R)-3,7-Dimethyl-6-octenoate
    • (+)-Citronellate
    • (R)-Citronellate
    • DTXCID30377292
    • (R)-(+)-Citronellic Acid
    • MDL: MFCD00075195
    • Inchi: 1S/C10H18O2/c1-8(2)5-4-6-9(3)7-10(11)12/h5,9H,4,6-7H2,1-3H3,(H,11,12)/t9-/m1/s1
    • InChI Key: GJWSUKYXUMVMGX-SECBINFHSA-N
    • SMILES: OC(C[C@H](C)CC/C=C(\C)/C)=O

Computed Properties

  • Exact Mass: 170.13074
  • Monoisotopic Mass: 170.130679813g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 5
  • Complexity: 167
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 1
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 3
  • Topological Polar Surface Area: 37.3?2

Experimental Properties

  • Color/Form: colorless liquid
  • Density: 0.926?g/mL?at 25?°C(lit.)
  • Boiling Point: 119?°C/3?mmHg(lit.)
  • Flash Point: Degrees Fahrenheit:235.4°F
    Degrees Celsius:113°C
  • Refractive Index: n20/D 1.4534(lit.)
  • Stability/Shelf Life: Stable. Combustible. Incompatible with strong oxidizing agents.
  • PSA: 37.3
  • Optical Activity: [α]25/D +8°, neat
  • Solubility: Not determined

(R)-(+)-Citronellic Acid Security Information

  • Symbol: GHS07
  • Signal Word:Warning
  • Hazard Statement: H312-H315
  • Warning Statement: P280
  • Hazardous Material transportation number:UN 2810 6.1/PG 3
  • WGK Germany:3
  • Hazard Category Code: 21-38
  • Safety Instruction: 26-36
  • Hazardous Material Identification: Xn
  • Risk Phrases:21-38

(R)-(+)-Citronellic Acid Pricemore >>

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