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CAS 73550-55-7 1-AMINOCYCLOBUTANE-CIS-1,3-DICARBOXYLIC ACID molecular structure lightbox
CAS RN: 73550-55-7

1-AMINOCYCLOBUTANE-CIS-1,3-DICARBOXYLIC ACID

Product Availability

Available package options are listed below.

1 package records0 with current stock
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250705 10mg Out of stock 15 business days Inquiry
  • Product code: starshine_CAS73550-55-7
  • Purity/Analytical Methods: >99.0%
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73550-55-7 / 1-aminocyclobutane-1,3-dicarboxylic acid

Standard CAS: 73550-55-7 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
73550-55-7
Multi CAS
Yes
Molecular Formula
C6H9NO4
Molecular Weight
159.140000
Exact Mass
159.053158
InChI
InChI=1S/C6H9NO4/c7-6(5(10)11)1-3(2-6)4(8)9/h3H,1-2,7H2,(H,8,9)(H,10,11)
InChIKey
GGMYWPBNZXRMME-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Fraction Csp3
0.67
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
3
Molar refractivity
34.91
TPSA
100.62

LogP / Solubility

WLOGP
-0.74
MLOGP
-0.65
XLogP3
-3.5
Consensus LogP
-1.63
Log S (ESOL)
-0.23
Class (ESOL)
Very soluble
Log S (Ali)
-0.33
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.32
Class (SILICOS-IT)
Very soluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.21

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

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