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CAS 33036-62-3 4-Bromo-1-butanol (contains varying amounts of Tetrahydrofuran) molecular structure lightbox
CAS RN: 33036-62-3

4-Bromo-1-butanol (contains varying amounts of Tetrahydrofuran)

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12 package records12 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260519 100g In stock Inquiry
Batchno.20260522 1g In stock Inquiry
Batchno.20250812 200mg In stock Inquiry
Batchno.20250506 25g In stock Inquiry
Batchno.20250530 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251208 100g In stock Shanghai, Tianjin Inquiry
Batchno.20260302 10g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250104 1g In stock Shanghai, Shenzhen, Tianjin, Wuhan Inquiry
Batchno.20251003 25g In stock Shanghai, Shenzhen, Tianjin, Wuhan Inquiry
Batchno.20250521 500g In stock Shanghai Inquiry
Batchno.20260531 5g In stock Shanghai, Shenzhen, Tianjin, Wuhan Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250821 1g / 5g / 25g / 100g / 500g Confirm by inquiry Shanghai, Shandong, Guangdong, Chongqing 5-7 business days Inquiry
  • Product code: ICTB1885
  • Purity/Analytical Methods: >80.0%(NMR)
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33036-62-3 / 4-bromobutan-1-ol

Standard CAS: 33036-62-3 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
33036-62-3
Multi CAS
Yes
Molecular Formula
C4H9BRO
Molecular Weight
153.020000
Exact Mass
151.983680
InChI
InChI=1S/C4H9BrO/c5-3-1-2-4-6/h6H,1-4H2
InChIKey
SIJLYRDVTMMSIP-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
6
Fraction Csp3
1
Rotatable bonds
3
H-bond acceptors
1
H-bond donors
1
Molar refractivity
30.11
TPSA
20.23

LogP / Solubility

WLOGP
1.15
MLOGP
1.01
XLogP3
0.6
Consensus LogP
0.92
Log S (ESOL)
-1.32
Class (ESOL)
Soluble
Log S (Ali)
-1.65
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.97
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)
-2.83

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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