[email protected]
CAS 7756-96-9 Butyl 2-Aminobenzoate molecular structure lightbox
CAS RN: 7756-96-9

Butyl 2-Aminobenzoate

Product Availability

Choose a grade to view its available package options.

2 package records2 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20250715 100ml In stock Inquiry
Batchno.20250622 25ml In stock Inquiry
  • Product code: SSC-187126
GET A QUOTE
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: 25ml
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
Request Bulk Quote

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 7756-96-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
25ml ≥95% 0 Out of Stock Hong Kong Inquiry

7756-96-9 / butyl 2-aminobenzoate

Standard CAS: 7756-96-9 Multi CAS: No
Basic Information Physical Properties Computed Properties

Basic Information

CAS
7756-96-9
Multi CAS
No
Molecular Formula
C11H15NO2
Molecular Weight
193.240000
Exact Mass
193.110279
InChI
InChI=1S/C11H15NO2/c1-2-3-8-14-11(13)9-6-4-5-7-10(9)12/h4-7H,2-3,8,12H2,1H3
InChIKey
HUIYGGQINIVDNW-UHFFFAOYSA-N

Physical Properties

Melting Point
less than 32 °F (NTP, 1992)
Boiling Point
360 °F at 760 mmHg (NTP, 1992) 303.00 °C. @ 760.00 mm Hg
Density
1.067-1.073
Physical Description
Butyl anthranilate is a dark brown liquid. Insoluble in water. (NTP, 1992) A colourless or very pale straw-Coloured liquid; Mild sweet, fruity, floral aroma
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
6
Fraction Csp3
0.36
Rotatable bonds
4
H-bond acceptors
3
H-bond donors
1
Molar refractivity
56.04
TPSA
52.32

LogP / Solubility

WLOGP
2.23
MLOGP
1.96
XLogP3
3.5
Consensus LogP
2.56
Log S (ESOL)
-2.49
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.75
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.24
Class (SILICOS-IT)
Poorly 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)
-2.32

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
1.5

Customers Also Viewed

Get In Touch

Contact Us