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CAS 1147557-97-8 tert-butyl 6-hydroxy-2-azaspiro[3.3]heptane-2-carboxylate molecular structure lightbox
CAS RN: 1147557-97-8

tert-butyl 6-hydroxy-2-azaspiro[3.3]heptane-2-carboxylate

Product Availability

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8 package records8 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260603 100g In stock Shanghai Inquiry
Batchno.20250207 100mg In stock Shanghai, Shenzhen, Wuhan, Chengdu Inquiry
Batchno.20260206 10g In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20250605 1g In stock Shanghai, Shenzhen, Tianjin, Chengdu Inquiry
Batchno.20250618 250mg In stock Shanghai, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20260525 25g In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20250410 500g In stock Shanghai Inquiry
Batchno.20250330 5g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
  • Product code: SSC-014489
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 1g, 5g, 25g, 0.25g, 10g, 100g
  • Available purity: >98%
  • Inventory rows with stock: 6
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1147557-97-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g >98% 5 In Stock Shenzhen Inquiry
5g >98% 5 In Stock Shanghai Inquiry
25g >98% 5 In Stock Beijing Inquiry
0.25g >98% 3 In Stock Shanghai Inquiry
10g >98% 3 In Stock Shenzhen Inquiry
100g >98% 2 In Stock Shanghai Inquiry

1147557-97-8 / tert-butyl 6-hydroxy-2-azaspiro[3.3]heptane-2-carboxylate

TERT-BUTYL 6-HYDROXY-2-AZASPIRO[3.3]HEPTANE-2-CARBOXYLATE | DTXSID80680960 | tert-Butyl 6-hydroxy-2-azaspiro(3.3)heptane-2-carboxylate

Standard CAS: 1147557-97-8 Multi CAS: Yes
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1147557-97-8
Multi CAS
Yes
Molecular Formula
C11H19NO3
Molecular Weight
213.270000
Exact Mass
213.136493
SMILES
CC(C)(C)OC(=O)N1CC2(C1)CC(C2)O
InChI
InChI=1S/C11H19NO3/c1-10(2,3)15-9(14)12-6-11(7-12)4-8(13)5-11/h8,13H,4-7H2,1-3H3
InChIKey
UMXXHZDEAZUQKZ-UHFFFAOYSA-N
Synonyms
TERT-BUTYL 6-HYDROXY-2-AZASPIRO[3.3]HEPTANE-2-CARBOXYLATE DTXSID80680960 tert-Butyl 6-hydroxy-2-azaspiro(3.3)heptane-2-carboxylate RefChem:383702 DTXCID70631709

Computed Properties

Structural Parameters

Heavy atom count
15
Fraction Csp3
0.91
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
1
Molar refractivity
55.48
TPSA
49.77

LogP / Solubility

WLOGP
1.38
MLOGP
1.21
XLogP3
0.9
Consensus LogP
1.16
Log S (ESOL)
-2.03
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.3
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.19
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)
-3.04

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (33.3%): Harmful if swallowed [Warning Acute toxicity, oral] H312 (33.3%): Harmful in contact with skin [Warning Acute toxicity, dermal] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H332 (33.3%): Harmful if inhaled [Warning Acute toxicity, inhalation]
Precautionary Statement Codes
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

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