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CAS 110529-22-1 (S)-(+)-2-[Hydroxy(diphenyl)methyl]-1-methylpyrrolidine molecular structure lightbox
CAS RN: 110529-22-1

(S)-(+)-2-[Hydroxy(diphenyl)methyl]-1-methylpyrrolidine

Product Availability

Choose a grade to view its available package options.

10 package records8 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250314 100mg In stock Inquiry
Batchno.20260626 1g In stock Inquiry
Batchno.20260131 250mg In stock Inquiry
Batchno.20260115 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250507 250mg / 1g / 5g / 25g Confirm by inquiry Shandong, Shanghai 8-10 business days Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251116 100mg In stock Tianjin Inquiry
Batchno.20260427 1g Out of stock Inquiry
Batchno.20250812 250mg In stock Tianjin Inquiry
Batchno.20250423 25g In stock Tianjin, Wuhan, Chengdu Inquiry
Batchno.20260623 5g Out of stock Inquiry
  • Product code: SSC-011579
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Historical Factory Record

Historical Supply Reference

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: 10g
  • Available purity: ≥97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 110529-22-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
10g ≥97% 0 Out of Stock Shenzhen Inquiry

110529-22-1 / [(2S)-1-methylpyrrolidin-2-yl]-diphenylmethanol

(1-methylpyrrolidin-2-yl)-diphenylmethanol | (s)-a,a-diphenylmethylprolinol | CBMicro_021527

Standard CAS: 110529-22-1 Multi CAS: Yes
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
110529-22-1
Multi CAS
Yes
Molecular Formula
C18H21NO
Molecular Weight
267.400000
Exact Mass
267.162314
SMILES
CN1CCC[C@H]1C(C2=CC=CC=C2)(C3=CC=CC=C3)O
InChI
InChI=1S/C18H21NO/c1-19-14-8-13-17(19)18(20,15-9-4-2-5-10-15)16-11-6-3-7-12-16/h2-7,9-12,17,20H,8,13-14H2,1H3/t17-/m0/s1
InChIKey
XIJAGFLYYNXCAB-KRWDZBQOSA-N
Synonyms
(1-methylpyrrolidin-2-yl)-diphenylmethanol (s)-a,a-diphenylmethylprolinol CBMicro_021527 (r)-alpha,alpha-diphenylmethylprolinol Oprea1_428688

Computed Properties

Structural Parameters

Heavy atom count
20
Aromatic heavy atom count
12
Fraction Csp3
0.33
Rotatable bonds
3
H-bond acceptors
2
H-bond donors
1
Molar refractivity
81.53
TPSA
23.47

LogP / Solubility

WLOGP
3.02
MLOGP
2.66
XLogP3
3.1
Consensus LogP
2.93
Log S (ESOL)
-3.64
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.93
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.26
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.21

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
2

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (97.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

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