CAS RN: 113304-85-1
(2R)-a,a-diMethyl-2-PyrrolidineMethanol
Product Availability
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1 package records 1 with current stock 1 grade group
Grade
95% (1)
In stock only
Batch No. Package Availability Warehouse Inquiry
Batchno.20251230
100mg / 250mg / 1g
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This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.
Pack sizes on record: 1g
Available purity: ≥95%
Inventory rows with stock: 0
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Recorded sizes, purity and stock details for CAS 113304-85-1
Pack Size
Recorded Purity
Available Qty
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Inquiry
1g
≥95%
0
Out of Stock
Hong Kong
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113304-85-1 / 2-[(2R)-pyrrolidin-2-yl]propan-2-ol
(r)-2-(pyrrolidin-2-yl)propan-2-ol | 2-[(2R)-pyrrolidin-2-yl]propan-2-ol | MFCD19218661
Standard CAS: 113304-85-1
Multi CAS: Yes
Basic Information
copy
CAS
113304-85-1 copy
Multi CAS
Yes copy
Molecular Formula
C7H15NO copy
Molecular Weight
129.200000 copy
Exact Mass
129.115364 copy
SMILES
CC(C)([C@H]1CCCN1)O copy
InChI
InChI=1S/C7H15NO/c1-7(2,9)6-4-3-5-8-6/h6,8-9H,3-5H2,1-2H3/t6-/m1/s1 copy
InChIKey
PSXWGNIMIRRWRB-ZCFIWIBFSA-N copy
Synonyms
(r)-2-(pyrrolidin-2-yl)propan-2-ol
2-[(2R)-pyrrolidin-2-yl]propan-2-ol
MFCD19218661
(2R)-A,A-DIMETHYL-2-PYRROLIDINEMETHANOL
(2R)-alpha,alpha-Dimethyl-2-pyrrolidinemethanol copy
Computed Properties
copy
Structural Parameters
Heavy atom count
9 copy
Fraction Csp3
1 copy
Rotatable bonds
1 copy
H-bond acceptors
2 copy
H-bond donors
2 copy
Molar refractivity
37.32 copy
TPSA
32.26 copy
LogP / Solubility
WLOGP
0.51 copy
MLOGP
0.44 copy
XLogP3
0.3 copy
Consensus LogP
0.42 copy
Log S (ESOL)
-0.9 copy
Class (ESOL)
Very soluble copy
Log S (Ali)
-0.99 copy
Class (Ali)
Very soluble copy
Log S (SILICOS-IT)
-1.04 copy
Class (SILICOS-IT)
Soluble copy
ADME
GI absorption
High copy
BBB permeant
Yes copy
P-gp substrate
No copy
CYP1A2 inhibitor
No copy
CYP2C19 inhibitor
No copy
CYP2C9 inhibitor
No copy
CYP2D6 inhibitor
No copy
CYP3A4 inhibitor
No copy
Log Kp (skin permeation)
-3.15 copy
Drug-likeness / Medicinal Chemistry
Lipinski
Yes copy
Ghose
No copy
Veber
Yes copy
Egan
Yes copy
Muegge
No copy
Bioavailability score
0.55 copy
Leadlikeness
No copy
Synthetic Accessibility
2 copy