CAS RN: 27360-07-2

POLY(VINYL BUTYRAL)

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Batchno.20260325 250g In stock Inquiry
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  • Product code: starshine_CAS27360-07-2
  • Purity/Analytical Methods: >99.0%
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27360-07-2 / 1,1-bis(ethenoxy)butane;ethenol;ethenyl acetate

Standard CAS: 27360-07-2 Multi CAS: Yes

Basic Information

CAS
27360-07-2
Multi CAS
Yes
Molecular Formula
C14H24O5
Molecular Weight
272.340000
Exact Mass
272.162374
InChI
InChI=1S/C8H14O2.C4H6O2.C2H4O/c1-4-7-8(9-5-2)10-6-3;1-3-6-4(2)5;1-2-3/h5-6,8H,2-4,7H2,1H3;3H,1H2,2H3;2-3H,1H2
InChIKey
RNNFCYZWIQZWQV-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
19
Fraction Csp3
0.36
Rotatable bonds
7
H-bond acceptors
5
H-bond donors
1
Molar refractivity
76.05
TPSA
64.99

LogP / Solubility

WLOGP
3.81
MLOGP
3.36
XLogP3
3.81
Consensus LogP
3.66
Log S (ESOL)
-3.47
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.55
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.44
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.67

Drug-likeness / Medicinal Chemistry

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

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