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CAS 1158760-45-2 3-METHYL-TETRAHYDROFURAN-3-CARBOXYLIC ACID molecular structure lightbox
CAS RN: 1158760-45-2

3-METHYL-TETRAHYDROFURAN-3-CARBOXYLIC ACID

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250520 100mg Out of stock 8-10 business days Inquiry
  • Product code: SSC-015670
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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, 25g
  • Available purity: >96%
  • Inventory rows with stock: 4
  • 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 1158760-45-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g >96% 1 In Stock Hong Kong Inquiry
0.25g >96% 1 In Stock Shenzhen Inquiry
1g >96% 1 In Stock Shanghai Inquiry
5g >96% 1 In Stock Shenzhen Inquiry
10g >96% 0 Out of Stock Shenzhen Inquiry
25g >96% 0 Out of Stock Beijing Inquiry

1158760-45-2 / 3-methyloxolane-3-carboxylic acid

Methyl Oxolane-3-carboxylate | RefChem:818007 | 827-686-1

Standard CAS: 1158760-45-2 Multi CAS: Yes
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1158760-45-2
Multi CAS
Yes
Molecular Formula
C6H10O3
Molecular Weight
130.140000
Exact Mass
130.062994
SMILES
CC1(CCOC1)C(=O)O
InChI
InChI=1S/C6H10O3/c1-6(5(7)8)2-3-9-4-6/h2-4H2,1H3,(H,7,8)
InChIKey
FLZNEKJUIYLHAR-UHFFFAOYSA-N
Synonyms
Methyl Oxolane-3-carboxylate RefChem:818007 827-686-1 Methyl tetrahydrofuran-3-carboxylate METHYL TETRAHYDRO-3-FUROATE

Computed Properties

Structural Parameters

Heavy atom count
9
Fraction Csp3
0.83
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
31.18
TPSA
46.53

LogP / Solubility

WLOGP
0.5
MLOGP
0.43
XLogP3
0.1
Consensus LogP
0.34
Log S (ESOL)
-0.89
Class (ESOL)
Very soluble
Log S (Ali)
-0.99
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-1.04
Class (SILICOS-IT)
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)
-3.16

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

Safety & Transport

Pictogram(s)
Corrosive Irritant
Signal
Danger
GHS Hazard Statements
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P403+P233, P405, and P501

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