CAS RN: 627-15-6
1,3-DibroMo-1-propene
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250813 | 5g | Out of stock | 15 business days | Inquiry |
- Product code: LIND920723
627-15-6 / (E)-1,3-dibromoprop-1-ene
Basic Information
CAS
627-15-6
Multi CAS
Yes
Molecular Formula
C3H4BR2
Molecular Weight
199.870000
Exact Mass
199.865930
InChI
InChI=1S/C3H4Br2/c4-2-1-3-5/h1-2H,3H2/b2-1+
InChIKey
JWQMKMSVOYQICF-OWOJBTEDSA-N
Computed Properties
Structural Parameters
Heavy atom count
5
Fraction Csp3
0.33
Rotatable bonds
1
Molar refractivity
31.86
TPSA
0.0000
LogP / Solubility
WLOGP
2.29
MLOGP
2.02
XLogP3
2
Consensus LogP
2.1
Log S (ESOL)
-2.46
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.85
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.98
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)
-2.31
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
Customers Also Viewed
-
-
1,3-Dibromo-2-(bromomethyl)-5-fluorobenzene
- CAS RN: 1804933-11-6
- Product Code: SSC-081304
-
-
1,3-Dicyclohexyl-4,5-dihydro-1H-imidazol-3-ium chloride
- CAS RN: 360067-61-4
- Product Code: SSC-143111
-
-
1,3-Dimethylimidazolidin-2-imine hydrochloride
- CAS RN: 87954-60-7
- Product Code: LIND901385
![CAS 7181-87-5 1,3-Dimethyl-1H-benzo[d]imidazol-3-ium iodide molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/7181-87-5.png)
