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CAS 251661-01-5 Carbamic acid, (1-methylcyclopropyl)-, 1,1-dimethylethyl ester (9CI) molecular structure lightbox
CAS RN: 251661-01-5

Carbamic acid, (1-methylcyclopropyl)-, 1,1-dimethylethyl ester (9CI)

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260228 100mg / 250mg / 1g / 5g Out of stock 5-7 business days Inquiry
  • Product code: SSC-120817
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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, 0.1g, 5g, 0.25g
  • Available purity: >95%
  • Inventory rows with stock: 3
  • 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 251661-01-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g >95% 4 In Stock Shenzhen Inquiry
0.1g >95% 1 In Stock Shanghai Inquiry
5g >95% 1 In Stock Shanghai Inquiry
0.25g >95% 0 Out of Stock Beijing Inquiry

251661-01-5 / 2-amino-3-cyclohexylpropanoic acid

Standard CAS: 251661-01-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
251661-01-5
Multi CAS
No
Molecular Formula
C9H17NO2
Molecular Weight
171.240000
Exact Mass
171.125929
SMILES
C1CCC(CC1)CC(C(=O)O)N
InChI
InChI=1S/C9H17NO2/c1-8(2,3)12-7(11)10-9(4)5-6-9/h5-6H2,1-4H3,(H,10,11)
InChIKey
PJNBAQDPGDFJRG-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Fraction Csp3
0.89
Rotatable bonds
3
H-bond acceptors
2
H-bond donors
2
Molar refractivity
46.8
TPSA
63.32

LogP / Solubility

WLOGP
1.37
MLOGP
1.2
XLogP3
-0.3
Consensus LogP
0.76
Log S (ESOL)
-1.57
Class (ESOL)
Soluble
Log S (Ali)
-1.95
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.27
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)
-2.79

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

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