(R) - (+) -Citronellic acid

CAT: 0024-sc-229089Size: 5 gDry Ice: NoHazardous: No

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CAS Number

18951-85-4

Chemical Information

(R)-(+)-citronellic acid

(R)-citronellic acid is a citronellic acid that has (R)-configuration. It is an enantiomer of a (S)-citronellic acid.

CAS Number	18951-85-4
PubChem CID	6999957
IUPAC Name	(3R)-3,7-dimethyloct-6-enoic acid
Molecular Formula	C10H18O2
Molecular Weight	170.25
XLogP	3
Topological Polar Surface Area	37.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	5
Heavy Atom Count	12
Formal Charge	0
Complexity	167

SMILES

C[C@H](CCC=C(C)C)CC(=O)O

InChI

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

InChIKey

GJWSUKYXUMVMGX-SECBINFHSA-N

Chemical Structure

2D Structure

CAS: 18951-85-4

CID: 6999957

Formula: C10H18O2

MW: 170.25

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	170.25
XLogP3	3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	5
Exact Mass	170.130679813
Monoisotopic Mass	170.130679813
Topological Polar Surface Area	37.3 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	167
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-257258	Citronellic acid
sc-229200	(S) - (-) -Citronellic acid
sc-236604	(R) - (+) -Citronellal
sc-229058	(R) - (+) -β-Citronellol
sc-236604A	(R) - (+) -Citronellal
sc-212661B	(R) - (+) -Verapamilic Acid
sc-212661A	(R) - (+) -Verapamilic Acid
sc-479716	(αR) -Acetyloxybenzenebutanoic Acid
sc-255495	(R) - (+) -Methylsuccinic acid
sc-205481A	R- (-) -Mandelic Acid

Catalog	Name
AAA50247	Citronellic Acid
OR55109	(R) - (+) -Citronellic acid
TRC-C525040-1G	(R)-(+)-Citronellic Acid
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MBS6083807-01	Medronic Acid (Methylenebiphosphonic Acid, Methylenediphosphonic Acid, Methanebisphosphonic Acid, Methanediphosphonic Acid, MDP)
L2500-01	Lipoic Acid (Thioctic Acid, (±) -α-Lipoic Acid)
041005	Cacodylic Acid (dimethylarsonic acid, dimethylarsinic acid)
MBS641082-01	Lipoic Acid (Thioctic Acid, Alpha Lipoic Acid)
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