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CAS 1177319-00-4 (CyclohexylMethyl)hydrazine dihydrochloride molecular structure lightbox
CAS RN: 1177319-00-4

(CyclohexylMethyl)hydrazine dihydrochloride

  • Product code: SSC-017572
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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
  • 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 1177319-00-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shanghai Inquiry

1177319-00-4 / cyclohexylmethylhydrazine;dihydrochloride

(cyclohexylmethyl)hydrazine dihydrochloride | cyclohexylmethylhydrazine;dihydrochloride | MFCD11857807

Standard CAS: 1177319-00-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1177319-00-4
Multi CAS
No
Molecular Formula
C7H18Cl2N2
Molecular Weight
201.130000
Exact Mass
200.084704
SMILES
C1CCC(CC1)CNN.Cl.Cl
InChI
InChI=1S/C7H16N2.2ClH/c8-9-6-7-4-2-1-3-5-7;;/h7,9H,1-6,8H2;2*1H
InChIKey
UNFWEMVEIFYVLW-UHFFFAOYSA-N
Synonyms
(cyclohexylmethyl)hydrazine dihydrochloride cyclohexylmethylhydrazine;dihydrochloride MFCD11857807 N-(Cyclohexylmethyl)hydrazine dihydrochloride cyclohexylmethylhydrazine dihydrochloride

Computed Properties

Structural Parameters

Heavy atom count
11
Fraction Csp3
1
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
2
Molar refractivity
53.26
TPSA
38.05

LogP / Solubility

WLOGP
1.87
MLOGP
1.65
XLogP3
1.87
Consensus LogP
1.8
Log S (ESOL)
-2.14
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.56
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.76
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)
-2.62

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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