1,5-Diaminopentane - ≥98% , CAS No.462-94-2

CAS: 462-94-2 Cat. No.: D121817 Formula: NH₂(CH₂)₅NH₂ Molecular Weight: 102.18 Beilstein Registry Number: 1697256 EC Number: 207-329-0

GRADE & PURITY ≥98%

Synonyms

BioDex 1- | EC 207-329-0 | UNII-L90BEN6OLL | 1,5-pentanediamine | AI3-26937 | Pentane-1,5-diamine | BBL027704 | CCG-266036 | L90BEN6OLL | MFCD00008239 | Cadaverin | 1,5-Diaminopentane | 1,5-diamino-pentane | cadaverine | DTXSID5075448 | 4-04-00-01310 (Bei

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice,FedEx DG Service

Overview

Cadaverine is a biogenic amine. Mechanism of cadaverine fermentation by Corynebacterium glutamicum was reported. Cadaverine, a diamine, has been reported as a cadaveric volatile organic compound. Its effect on the electroantennographic (EAG) and behavioral responses of silphine species, Thanatophilus sinuatus Fabricius has been investigated. 

Application：

Cadaverine has been used as diamine in the synthesis of diamine-inorganic anion [Cl-, SO42-, HPO42-, P2O74- and Fe(CN)64-] complexes

Specifications

Synonyms

BioDex 1- | EC 207-329-0 | UNII-L90BEN6OLL | 1,5-pentanediamine | AI3-26937 | Pentane-1,5-diamine | BBL027704 | CCG-266036 | L90BEN6OLL | MFCD00008239 | Cadaverin | 1,5-Diaminopentane | 1,5-diamino-pentane | cadaverine | DTXSID5075448 | 4-04-00-01310 (Bei

Specifications & Purity

≥98%

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice,FedEx DG Service

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥98%

Names and Identifiers

Pubchem Sid

508807108

Canonical Smiles

C(CCN)CCN

IUPAC Name

pentane-1,5-diamine

InChIKey

VHRGRCVQAFMJIZ-UHFFFAOYSA-N

INCHI

1S/C5H14N2/c6-4-2-1-3-5-7/h1-7H2

Isomeric SMILES

C(CCN)CCN

WGK Germany

3

RTECS

SA0200000

UN Number

2735

Packing Group

III

Molecular Weight

102.18

Beilstein

1697256

Reaxy-Rn

1697256

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1697256&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Class Organonitrogen compounds
      • Subclass Amines
        • Level5 Primary amines
          • Level6 Monoalkylamines

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Class: Organonitrogen compounds
• Subclass: Amines
• Intermediate Tree Nodes: Primary amines
• Direct Parent: Monoalkylamines
• Alternative Parents: Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Organopnictogen compound - Hydrocarbon derivative - Primary aliphatic amine - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as monoalkylamines. These are organic compounds containing an primary aliphatic amine group.
• External Descriptors: an aliphatic α,ω-diamine

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Associated Targets(Human)

CA5A Tclin Carbonic anhydrase 5A, mitochondrial (1 Activities)

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CA5B Tclin Carbonic anhydrase 5B, mitochondrial (1 Activities)

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CA6 Tclin Carbonic anhydrase 6 (1 Activities)

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CA3 Tclin Carbonic anhydrase 3 (1 Activities)

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CA4 Tclin Carbonic anhydrase 4 (1 Activities)

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CA12 Tclin Carbonic anhydrase 12 (1 Activities)

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CA14 Tclin Carbonic anhydrase 14 (1 Activities)

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CA9 Tclin Carbonic anhydrase 9 (1 Activities)

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CA7 Tclin Carbonic anhydrase 7 (1 Activities)

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CA2 Tclin Carbonic anhydrase II (17698 Activities)

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CA3 Tclin Carbonic anhydrase III (753 Activities)

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CA6 Tclin Carbonic anhydrase VI (993 Activities)

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CA1 Tclin Carbonic anhydrase I (13240 Activities)

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CA5B Tclin Carbonic anhydrase VB (957 Activities)

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CA5A Tclin Carbonic anhydrase VA (1168 Activities)

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CA14 Tclin Carbonic anhydrase XIV (1305 Activities)

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CA12 Tclin Carbonic anhydrase XII (6231 Activities)

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CA9 Tclin Carbonic anhydrase IX (8255 Activities)

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POLK Tbio DNA polymerase kappa (8653 Activities)

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Associated Targets(non-human)

Ca7 Carbonic anhydrase VII (3 Activities)

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Ca13 Carbonic anhydrase XIII (322 Activities)

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CA4 Carbonic anhydrase IV (1713 Activities)

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Mycobacterium tuberculosis (203094 Activities)

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Plasmodium falciparum (966862 Activities)

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J774 (3120 Activities)

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rep Replicase polyprotein 1ab (378 Activities)

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Ca15 Carbonic anhydrase 15 (173 Activities)

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Mechanisms of Action

Chemical and Physical Properties

• Solubility: Soluble in water.
• Sensitivity: Air & Moisture Sensitive
• Refractive Index: 1.4585
• Flash Point(°F): 143.6 °F
• Flash Point(°C): 62 °C
• Boil Point(°C): 180°C
• Melt Point(°C): 9.34°C
• Molecular Weight: 102.180 g/mol
• XLogP3: -0.600
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 102.116 Da
• Monoisotopic Mass: 102.116 Da
• Topological Polar Surface Area: 52.000 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 25.300
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1