CAS 18951-85-4 (R)-(+)-CITRONELLIC ACID molecular structure

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CAS RN: 18951-85-4

(R)-(+)-CITRONELLIC ACID

Product Availability

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1 package records1 with current stock1 grade group

Grade In stock only

Batch No.	Package	Availability	Warehouse	Inquiry
Batchno.20251202	100mg / 250mg / 1g / 5g	Confirm by inquiry	Shanghai, Shandong	Inquiry

Product code: SSC-088635

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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

Pack sizes on record: 0.1g, 0.25g, 1g, 5g, 10g
Available purity: ≥95%
Inventory rows with stock: 3
Bulk packaging: confirmed by inquiry

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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 18951-85-4
Pack Size	Recorded Purity	Available Qty	Ship From	Inquiry
0.1g	≥95%	1 In Stock	Shanghai	Inquiry
0.25g	≥95%	1 In Stock	Shanghai	Inquiry
1g	≥95%	1 In Stock	Beijing	Inquiry
5g	≥95%	0 Out of Stock	Shanghai	Inquiry
10g	≥95%	0 Out of Stock	Hong Kong	Inquiry

18951-85-4 / (3R)-3,7-dimethyloct-6-enoic acid

Standard CAS: 18951-85-4 Multi CAS: No

Basic Information Computed Properties Safety & Transport

Basic Information

CAS

18951-85-4

Multi CAS

Molecular Formula

C10H18O2

Molecular Weight

170.250000

Exact Mass

170.130680

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

Computed Properties

Structural Parameters

Heavy atom count

Fraction Csp3

0.7

Rotatable bonds

H-bond acceptors

H-bond donors

Molar refractivity

50.08

TPSA

37.3

LogP / Solubility

WLOGP

2.84

MLOGP

2.5

XLogP3

Consensus LogP

2.78

Log S (ESOL)

-2.36

Class (ESOL)

Moderately soluble

Log S (Ali)

-3.01

Class (Ali)

Poorly soluble

Log S (SILICOS-IT)

-3.73

Class (SILICOS-IT)

Poorly soluble

ADME

GI absorption

High

BBB permeant

Yes

P-gp substrate

CYP1A2 inhibitor

CYP2C19 inhibitor

CYP2C9 inhibitor

CYP2D6 inhibitor

CYP3A4 inhibitor

Log Kp (skin permeation)

-1.74

Drug-likeness / Medicinal Chemistry

Lipinski

Yes

Ghose

Veber

Yes

Egan

Yes

Muegge

Bioavailability score

0.55

Brenk alerts

Leadlikeness

Synthetic Accessibility

Safety & Transport

Pictogram(s)

Irritant

Signal

Warning

GHS Hazard Statements

H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

Precautionary Statement Codes

P264, P280, P302+P352, P317, P321, P332+P317, P362+P364, and P501

Applications of CAS 18951-85-4

This compound is commonly used in general chemistry research and laboratory applications. Starshine Chemical supplies CAS 18951-85-4 for R&D and pilot-scale use, with flexible pack sizes and purity grades available.

Storage & Handling

Storage: Keep the container tightly closed in a cool, dry and well-ventilated place. For detailed hazard, storage and transport information, request the SDS (Safety Data Sheet) with your inquiry.

Quotation & Packaging

Prices are confirmed by inquiry. Request a quote for current pricing, minimum order quantity (MOQ) and lead time. The pack sizes listed on this page are reference options; custom pack sizes and bulk quantities are available on request.

Quality & Compliance

Specifications and purity shown on this page are based on batch records. A Certificate of Analysis (COA) is available on request. For research and further manufacturing use only — not for direct human or therapeutic use.