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CAS 6291-84-5 N-Methyl-1,3-diaminopropane molecular structure lightbox
CAS RN: 6291-84-5

N-Methyl-1,3-diaminopropane

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250826 25ml / 100ml / 500ml / 2.5L Confirm by inquiry Shanghai, Shandong, Hebei Inquiry
  • Product code: SSC-172350
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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: 500g
  • Available purity: ＞97%
  • 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 6291-84-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
500g ＞97% 0 Out of Stock Shenzhen Inquiry

6291-84-5 / N'-methylpropane-1,3-diamine

Standard CAS: 6291-84-5 Multi CAS: Yes
Basic Information Physical Properties Computed Properties

Basic Information

CAS
6291-84-5
Multi CAS
Yes
Molecular Formula
C4H12N2
Molecular Weight
88.150000
Exact Mass
88.100048
InChI
InChI=1S/C4H12N2/c1-6-4-2-3-5/h6H,2-5H2,1H3
InChIKey
QHJABUZHRJTCAR-UHFFFAOYSA-N

Physical Properties

Boiling Point
282 to 286 °F at 760 mmHg (NTP, 1992)
Density
0.844 (NTP, 1992) - Less dense than water; will float
Physical Description
3-methylaminopropylamine is a dark amber liquid. (NTP, 1992)
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
6
Fraction Csp3
1
Rotatable bonds
3
H-bond acceptors
2
H-bond donors
2
Molar refractivity
27.6
TPSA
38.05

LogP / Solubility

WLOGP
-0.45
MLOGP
-0.41
XLogP3
-0.8
Consensus LogP
-0.55
Log S (ESOL)
0.09
Class (ESOL)
Highly soluble
Log S (Ali)
0.04
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
-0.22
Class (SILICOS-IT)
Very soluble

ADME

GI absorption
Low
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)
-3.57

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

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