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CAS 135112-27-5 (S)-2-[[[(9H-Fluoren-9-yl)methoxy]carbonyl]amino]butanoic Acid molecular structure lightbox
CAS RN: 135112-27-5

(S)-2-[[[(9H-Fluoren-9-yl)methoxy]carbonyl]amino]butanoic Acid

Product Availability

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8 package records7 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250506 100g In stock Inquiry
Batchno.20260130 25g In stock Inquiry
Batchno.20260623 500g In stock Inquiry
Batchno.20250807 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250718 100g In stock Shandong Inquiry
Batchno.20250327 25g In stock Shanghai, Shandong, Guangdong, Chongqing Inquiry
Batchno.20260620 500g Out of stock 8-10 business days Inquiry
Batchno.20250128 5g In stock Shanghai Inquiry
  • Product code: SSC-043037
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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: 5g, 10g, 25g, 100g
  • Available purity: ≥98%
  • Inventory rows with stock: 1
  • 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 135112-27-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥98% 1 In Stock Beijing Inquiry
10g ≥98% 0 Out of Stock Hong Kong Inquiry
25g ≥98% 0 Out of Stock Hong Kong Inquiry
100g ≥98% 0 Out of Stock Shenzhen Inquiry

135112-27-5 / (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)butanoic acid

Standard CAS: 135112-27-5 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
135112-27-5
Multi CAS
No
Molecular Formula
C19H19NO4
Molecular Weight
325.400000
Exact Mass
325.131408
SMILES
CC[C@@H](C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13
InChI
InChI=1S/C19H19NO4/c1-2-17(18(21)22)20-19(23)24-11-16-14-9-5-3-7-12(14)13-8-4-6-10-15(13)16/h3-10,16-17H,2,11H2,1H3,(H,20,23)(H,21,22)/t17-/m0/s1
InChIKey
XQIRYUNKLVPVRR-KRWDZBQOSA-N

Computed Properties

Structural Parameters

Heavy atom count
24
Aromatic heavy atom count
12
Fraction Csp3
0.26
Rotatable bonds
5
H-bond acceptors
3
H-bond donors
2
Molar refractivity
89.92
TPSA
75.63

LogP / Solubility

WLOGP
3.39
MLOGP
3
XLogP3
3.6
Consensus LogP
3.33
Log S (ESOL)
-4.03
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.67
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.19
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.3

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
3

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 (100%): 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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