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CAS 18448-47-0 Methyl 1-cyclohexene-1-carboxylate molecular structure lightbox
CAS RN: 18448-47-0

Methyl 1-cyclohexene-1-carboxylate

Product Availability

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3 package records2 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251023 1g In stock Shandong Inquiry
Batchno.20250113 25g Out of stock 5-7 business days Inquiry
Batchno.20260401 5g In stock Shanghai Inquiry
  • Product code: SSC-085282
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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: 5g, 1g, 10g, 25g, 100g
  • Available purity: ≥98%
  • Inventory rows with stock: 5
  • 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 18448-47-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥98% 5 In Stock Shanghai Inquiry
1g ≥98% 4 In Stock Beijing Inquiry
10g ≥98% 4 In Stock Shanghai Inquiry
25g ≥98% 4 In Stock Shanghai Inquiry
100g ≥98% 2 In Stock Hong Kong Inquiry

18448-47-0 / methyl cyclohexene-1-carboxylate

Standard CAS: 18448-47-0 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
18448-47-0
Multi CAS
No
Molecular Formula
C8H12O2
Molecular Weight
140.180000
Exact Mass
140.083730
SMILES
COC(=O)C1=CCCCC1
InChI
InChI=1S/C8H12O2/c1-10-8(9)7-5-3-2-4-6-7/h5H,2-4,6H2,1H3
InChIKey
KXPWRCPEMHIZGU-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Fraction Csp3
0.62
Rotatable bonds
1
H-bond acceptors
2
Molar refractivity
38.57
TPSA
26.3

LogP / Solubility

WLOGP
1.66
MLOGP
1.45
XLogP3
2
Consensus LogP
1.7
Log S (ESOL)
-1.69
Class (ESOL)
Soluble
Log S (Ali)
-1.91
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.07
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.4

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H227 (100%): Combustible liquid [Warning Flammable liquids] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P210, P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403, P403+P233, P405, and P501

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