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CAS 4472-41-7 N,N-Dimethylformamide-d7 99.5atom%D molecular structure lightbox
CAS RN: 4472-41-7

N,N-Dimethylformamide-d7 99.5atom%D

  • Product code: SSC-152734
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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: 1g, 5g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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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 4472-41-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Hong Kong Inquiry
5g ≥95% 0 Out of Stock Shenzhen Inquiry

4472-41-7 / 1-deuterio-N,N-bis(trideuteriomethyl)formamide

Standard CAS: 4472-41-7 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
4472-41-7
Multi CAS
Yes
Molecular Formula
C3H7NO
Molecular Weight
80.140000
Exact Mass
80.096701
InChI
InChI=1S/C3H7NO/c1-4(2)3-5/h3H,1-2H3/i1D3,2D3,3D
InChIKey
ZMXDDKWLCZADIW-YYWVXINBSA-N

Computed Properties

Structural Parameters

Heavy atom count
5
Fraction Csp3
0.67
Rotatable bonds
1
H-bond acceptors
1
Molar refractivity
19.75
TPSA
20.31

LogP / Solubility

WLOGP
-0.3
MLOGP
-0.28
XLogP3
-1
Consensus LogP
-0.53
Log S (ESOL)
-0.04
Class (ESOL)
Very soluble
Log S (Ali)
0.05
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
-0.01
Class (SILICOS-IT)
Very 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)
-3.38

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

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