2-Chloro-N-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine - Reagent grade , CAS No.76780-98-8

CAS: 76780-98-8 Cat. No.: C479470 Molecular Weight: 183.64
AVAILABLE TO ORDER
GRADE & PURITY Reagent Grade ? General reagent-grade purity suitable for most laboratory work. Use as a dependable default when no specific higher grade is required.
Synonyms
2-Chloro-N-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine, AldrichCPR | SCHEMBL11290218 | MFCD11505291 | AKOS006323345 | 2-Chloro-N-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine | FT-0717210 | BDA78098 | BS-36263 | DTXSID90504067
Storage
Room temperature
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Size
Status
Price
Qty
1g
C479470-1g
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$504.90
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Why this grade

Reagent grade Reagent Grade for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Room temperature Ships Check lot-specific COA for exact specifications.

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Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

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Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms
2-Chloro-N-methyl-6, 7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine, AldrichCPR | SCHEMBL11290218 | MFCD11505291 | AKOS006323345 | 2-Chloro-N-methyl-6, 7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine | FT-0717210 | BDA78098 | BS-36263 | DTXSID90504067
Specifications & Purity
Reagent grade
Legal Information
Product of ChemBridge Corp.
Storage
Room temperature
Grade
Reagent Grade
Names and Identifiers
Canonical SmilesCNC1=NC(=NC2=C1CCC2)Cl
IUPAC Name2-chloro-N-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
InChIKeyQUHPTBBMGYVJPK-UHFFFAOYSA-N
INCHI1S/C8H10ClN3/c1-10-7-5-3-2-4-6(5)11-8(9)12-7/h2-4H2,1H3,(H,10,11,12)
Isomeric SMILES CNC1=NC(=NC2=C1CCC2)Cl
WGK Germany 3
Molecular Weight 183.64
Reaxy-Rn 5517407
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=5517407&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

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✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

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📊 Datasheet

Quick-reference summary of product specifications and applications.

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🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

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Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClassDiazines
SubclassPyrimidines and pyrimidine derivatives
Intermediate Tree Nodes Not available
Direct ParentAminopyrimidines and derivatives
Alternative Parents 2-halopyrimidines  Imidolactams  Aryl chlorides  Heteroaromatic compounds  Azacyclic compounds  Organochlorides  Hydrocarbon derivatives  Amines  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents 2-halopyrimidine - Halopyrimidine - Aminopyrimidine - Imidolactam - Aryl halide - Aryl chloride - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organochloride - Organohalogen compound - Amine - Aromatic heteropolycyclic compound
DescriptionThis compound belongs to the class of organic compounds known as aminopyrimidines and derivatives. These are organic compounds containing an amino group attached to a pyrimidine ring. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Chemical and Physical Properties
Molecular Weight183.640 g/mol
XLogP32.200
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass183.056 Da
Monoisotopic Mass183.056 Da
Topological Polar Surface Area37.800 Ų
Heavy Atom Count12
Formal Charge0
Complexity164.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Documents & Articles
Solution Calculators
Reviews

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