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CAS 628-50-2 3-Methylbutyl Chloroformate molecular structure lightbox
CAS RN: 628-50-2

3-Methylbutyl Chloroformate

Product Availability

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3 package records2 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260115 1g In stock Shanghai Inquiry
Batchno.20250906 25g Out of stock 5-7 business days Inquiry
Batchno.20260616 5g In stock Shanghai, Hebei Inquiry
  • Product code: SSC-172140
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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: 1g, 5g, 0.1g, 0.25g, 10g, 25g
  • Available purity: tech. 90%
  • 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 628-50-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g tech. 90% 4 In Stock Beijing Inquiry
5g tech. 90% 2 In Stock Beijing Inquiry
0.1g tech. 90% 1 In Stock Shenzhen Inquiry
0.25g tech. 90% 1 In Stock Hong Kong Inquiry
10g tech. 90% 0 Out of Stock Shenzhen Inquiry
25g tech. 90% 0 Out of Stock Shenzhen Inquiry

628-50-2 / 3-methylbutyl carbonochloridate

Standard CAS: 628-50-2 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
628-50-2
Multi CAS
No
Molecular Formula
C6H11CLO2
Molecular Weight
150.600000
Exact Mass
150.044757
InChI
InChI=1S/C6H11ClO2/c1-5(2)3-4-9-6(7)8/h5H,3-4H2,1-2H3
InChIKey
KCCKTIKZOIPZTG-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
9
Fraction Csp3
0.83
Rotatable bonds
3
H-bond acceptors
2
Molar refractivity
36.66
TPSA
26.3

LogP / Solubility

WLOGP
2.41
MLOGP
2.11
XLogP3
2.9
Consensus LogP
2.47
Log S (ESOL)
-2.09
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.53
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3
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)
-1.93

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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