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CAS 1202033-17-7 (2S,2’S,3S,3’S)-BIBOP molecular structure lightbox
CAS RN: 1202033-17-7

(2S,2’S,3S,3’S)-BIBOP

Product Availability

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6 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250219 100mg In stock Shanghai, Tianjin, Chengdu Inquiry
Batchno.20250825 100mg / 250mg / 1g Out of stock 5-7 business days Inquiry
Batchno.20250127 1g In stock Shanghai Inquiry
Batchno.20250322 250mg In stock Shanghai Inquiry
Batchno.20250415 50mg In stock Shanghai Inquiry
Batchno.20250429 5g In stock Shanghai Inquiry
  • Product code: SSC-021043
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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: 1g
  • 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 1202033-17-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥97% 0 Out of Stock Shanghai Inquiry

1202033-17-7 / (2S,3S)-3-tert-butyl-2-[(2S,3S)-3-tert-butyl-2H-1,3-benzoxaphosphol-2-yl]-2H-1,3-benzoxaphosphole

MFCD31707603 | (2S,2'S,3S,3'S)-BIBOP | (2S,2'S,3S,3'S)-3,3'-Bis(1,1-dimethylethyl)-2,2',3,3'-tetrahydro-2,2'-bi-1,3-benzoxaphosphole

Standard CAS: 1202033-17-7 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
1202033-17-7
Multi CAS
Yes
Molecular Formula
C22H28O2P2
Molecular Weight
386.400000
Exact Mass
386.156454
SMILES
CC(C)(C)[P@@]1[C@H](OC2=CC=CC=C21)[C@H]3OC4=CC=CC=C4[P@@]3C(C)(C)C
InChI
InChI=1S/C22H28O2P2/c1-21(2,3)25-17-13-9-7-11-15(17)23-19(25)20-24-16-12-8-10-14-18(16)26(20)22(4,5)6/h7-14,19-20H,1-6H3/t19-,20-,25-,26-/m0/s1
InChIKey
CAVTUIDTRDJLGP-HKDRDPIHSA-N
Synonyms
MFCD31707603 (2S,2'S,3S,3'S)-BIBOP (2S,2'S,3S,3'S)-3,3'-Bis(1,1-dimethylethyl)-2,2',3,3'-tetrahydro-2,2'-bi-1,3-benzoxaphosphole (2S,2'S,3S,3'S)-3,3'-di-tert-butyl-2,2',3,3'-tetrahydro- 2,2'-bibenzo[d][1,3]oxaphospho le (2S,2'S,3S,3'S)-3,3'-di-tert-butyl-2,2',3,3'-tetrahydro-2,2'-bibenzo[d][1,3]oxaphosphole

Computed Properties

Structural Parameters

Heavy atom count
26
Aromatic heavy atom count
12
Fraction Csp3
0.45
Rotatable bonds
1
H-bond acceptors
2
Molar refractivity
114.33
TPSA
18.46

LogP / Solubility

WLOGP
5.64
MLOGP
4.98
XLogP3
4.5
Consensus LogP
5.04
Log S (ESOL)
-6.06
Class (ESOL)
Insoluble
Log S (Ali)
-6.8
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-6.97
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.08

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
5

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