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cis-3-(benzyloxycarbonylamino)cyclopentanecarboxylic acid - 97%, high purity , CAS No.19946-44-2

COA

Grade & Purity:

≥97%

Cas Number: 19946-44-2
Molecular Weight: 263.29
EC Number: 938-026-8
PubChem CID: 66545224

In stock

Item Number

C631353

Grouped product items
SKU	Size	Availability	Price
C631353-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$100.90
C631353-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$304.90
C631353-10g	10g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$539.90

Basic Description

Synonyms	1380486-21-4 \| (1S,3R)-3-{[(benzyloxy)carbonyl]amino}cyclopentane-1-carboxylic acid \| 19946-44-2 \| Cis-n-cbz-3-aminocyclopentanecarboxylic acid \| (1S,3R)-3-{[(Benzyloxy)carbonyl]amino}-cyclopentane-1-carboxylic acid \| (1S,3R)-3-(phenylmethoxycarbonylamino
Specifications & Purity	≥97%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic acids and derivatives
  - Class Carboxylic acids and derivatives
    - Subclass Amino acids, peptides, and analogues
      - Level5 Amino acids and derivatives
        Level6 Gamma amino acids and derivatives

Kingdom	Organic compounds
Superclass	Organic acids and derivatives
Class	Carboxylic acids and derivatives
Subclass	Amino acids, peptides, and analogues
Intermediate Tree Nodes	Amino acids and derivatives
Direct Parent	Gamma amino acids and derivatives
Alternative Parents	Benzyloxycarbonyls Carbamate esters Monocarboxylic acids and derivatives Carboxylic acids Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Gamma amino acid or derivatives - Benzyloxycarbonyl - Benzenoid - Monocyclic benzene moiety - Carbamic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as gamma amino acids and derivatives. These are amino acids having a (-NH2) group attached to the gamma carbon atom.
External Descriptors	Not available
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

Names and Identifiers

IUPAC Name	(1S,3R)-3-(phenylmethoxycarbonylamino)cyclopentane-1-carboxylic acid
INCHI	InChI=1S/C14H17NO4/c16-13(17)11-6-7-12(8-11)15-14(18)19-9-10-4-2-1-3-5-10/h1-5,11-12H,6-9H2,(H,15,18)(H,16,17)/t11-,12+/m0/s1
InChIKey	DEHMZYGMZLWARX-NWDGAFQWSA-N
Smiles	C1CC(CC1C(=O)O)NC(=O)OCC2=CC=CC=C2
Isomeric SMILES	C1C[C@H](C[C@H]1C(=O)O)NC(=O)OCC2=CC=CC=C2
PubChem CID	66545224
Molecular Weight	263.29

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	263.290 g/mol
XLogP3	1.900
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	5
Exact Mass	263.116 Da
Monoisotopic Mass	263.116 Da
Topological Polar Surface Area	75.600 Å²
Heavy Atom Count	19
Formal Charge	0
Complexity	325.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
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

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