5-Guanidinopentanoic acid - CAS 462-93-1
Catalog: |
BB055194 |
Product Name: |
5-Guanidinopentanoic acid |
CAS: |
462-93-1 |
Synonyms: |
delta-Guanidinovaleric acid; 5-guanidinopentanoic acid; 5-carbamimidamidopentanoic acid; 5-(diaminomethylideneamino)pentanoic acid; 5-{[amino(Imino)methyl]amino}pentanoic Acid; delta-guanidinovalerate |
IUPAC Name: | 5-(diaminomethylideneamino)pentanoic acid |
Molecular Weight: | 159.19 |
Molecular Formula: | C6H13N3O2 |
Canonical SMILES: | C(CCN=C(N)N)CC(=O)O |
InChI: | InChI=1S/C6H13N3O2/c7-6(8)9-4-2-1-3-5(10)11/h1-4H2,(H,10,11)(H4,7,8,9) |
InChI Key: | UKUBCVAQGIZRHL-UHFFFAOYSA-N |
Complexity: | 152 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 159.100776666 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 159.100776666 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 102Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -1.1 |
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