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CAS 1885-38-7 Cinnamonitrile molecular structure lightbox
CAS RN: 1885-38-7

Cinnamonitrile

Product Availability

Choose a grade to view its available package options.

2 package records2 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260129 25g / 100g / 500g / 2.5kg / 10kg Confirm by inquiry Shanghai, Shandong, Chongqing, Hebei Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250623 25g / 100g / 500g Confirm by inquiry Shanghai 8-10 business days Inquiry
  • Product code: SSC-087723
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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: 10g, 25g, 100g, 500g
  • Available purity: ≥97%
  • 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 1885-38-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
10g ≥97% 3 In Stock Beijing Inquiry
25g ≥97% 0 Out of Stock Beijing Inquiry
100g ≥97% 0 Out of Stock Shanghai Inquiry
500g ≥97% 0 Out of Stock Shenzhen Inquiry

1885-38-7 / (E)-3-phenylprop-2-enenitrile

Standard CAS: 1885-38-7 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1885-38-7
Multi CAS
No
Molecular Formula
C9H7N
Molecular Weight
129.160000
Exact Mass
129.057849
SMILES
C1=CC=C(C=C1)/C=C/C#N
InChI
InChI=1S/C9H7N/c10-8-4-7-9-5-2-1-3-6-9/h1-7H/b7-4+
InChIKey
ZWKNLRXFUTWSOY-QPJJXVBHSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
6
Rotatable bonds
1
H-bond acceptors
1
Molar refractivity
41.09
TPSA
23.79

LogP / Solubility

WLOGP
2.22
MLOGP
1.95
XLogP3
2
Consensus LogP
2.06
Log S (ESOL)
-2.42
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.22
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.46
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)
-1.93

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

Safety & Transport

Pictogram(s)
Acute Toxic Irritant
Signal
Danger
GHS Hazard Statements
H301 (98.4%): Toxic if swallowed [Danger Acute toxicity, oral] H312 (98.5%): Harmful in contact with skin [Warning Acute toxicity, dermal] H317 (98.5%): May cause an allergic skin reaction [Warning Sensitization, Skin] H301 (86%): Toxic if swallowed [Danger Acute toxicity, oral] H312 (86.3%): Harmful in contact with skin [Warning Acute toxicity, dermal]
Precautionary Statement Codes
P261, P264, P270, P272, P280, P301+P316, P302+P352, P317, P321, P330, P333+P317, P362+P364, P405, and P501 P261, P264, P264+P265, P270, P271, P272, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P403+P233, P405, and P501

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