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CAS 1125-88-8 Benzaldehyde Dimethyl Acetal molecular structure lightbox
CAS RN: 1125-88-8

Benzaldehyde Dimethyl Acetal

Product Availability

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5 package records4 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250115 100g In stock Inquiry
Batchno.20260317 2.5kg Out of stock Inquiry
Batchno.20260628 25g In stock Inquiry
Batchno.20260428 500g In stock Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250110 25g / 100g / 500g / 2.5kg / 10kg Confirm by inquiry Shanghai, Shandong, Guangdong, Chongqing, Hebei 5-7 business days Inquiry
  • Product code: SSC-012905
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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: 25g, 100g, 1000g, 500g, 5000g, 10000g, 25000g
  • Available purity: >98%
  • Inventory rows with stock: 7
  • 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 1125-88-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
25g >98% 5 In Stock Hong Kong Inquiry
100g >98% 5 In Stock Shanghai Inquiry
1000g >98% 5 In Stock Shenzhen Inquiry
500g >98% 2 In Stock Beijing Inquiry
5000g >98% 1 In Stock Shanghai Inquiry
10000g >98% 1 In Stock Shenzhen Inquiry
25000g >98% 1 In Stock Hong Kong Inquiry

1125-88-8 / dimethoxymethylbenzene

Benzaldehyde dimethyl acetal | (dimethoxymethyl)benzene | Dimethoxyphenylmethane

Standard CAS: 1125-88-8 Multi CAS: No
Basic Information Physical Properties Computed Properties Safety & Transport

Basic Information

CAS
1125-88-8
Multi CAS
No
Molecular Formula
C9H12O2
Molecular Weight
152.190000
Exact Mass
152.083730
SMILES
COC(C1=CC=CC=C1)OC
InChI
InChI=1S/C9H12O2/c1-10-9(11-2)8-6-4-3-5-7-8/h3-7,9H,1-2H3
InChIKey
HEVMDQBCAHEHDY-UHFFFAOYSA-N
Synonyms
Benzaldehyde dimethyl acetal (dimethoxymethyl)benzene Dimethoxyphenylmethane alpha,alpha-Dimethoxytoluene BENZENE, (DIMETHOXYMETHYL)-

Physical Properties

Boiling Point
87.00 to 89.00 °C. @ 18.00 mm Hg
Density
1.007-1.020
Physical Description
colourless liquid with a sweet, floral-almond odour
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.33
Rotatable bonds
3
H-bond acceptors
2
Molar refractivity
43.2
TPSA
18.46

LogP / Solubility

WLOGP
1.98
MLOGP
1.73
XLogP3
1.6
Consensus LogP
1.77
Log S (ESOL)
-2.24
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.24
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.65
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)
-2.24

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)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (99.7%): Harmful if swallowed [Warning Acute toxicity, oral] H315 (20.9%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (13.8%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (13.4%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

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