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310872-08-3 | 1,2-Cyclopentanediamine, hydrochloride (1:2), (1R,2S)-rel-
CAS No: 310872-08-3 Catalog No: AG003232 MDL No:
Product Description
Catalog Number:
AG003232
Chemical Name:
1,2-Cyclopentanediamine, hydrochloride (1:2), (1R,2S)-rel-
CAS Number:
310872-08-3
Molecular Formula:
C5H14Cl2N2
Molecular Weight:
173.0841
IUPAC Name:
(1S,2R)-cyclopentane-1,2-diamine;dihydrochloride
InChI:
InChI=1S/C5H12N2.2ClH/c6-4-2-1-3-5(4)7;;/h4-5H,1-3,6-7H2;2*1H/t4-,5+;;
InChI Key:
VZCLGIZICFQJBX-QGAATHCOSA-N
SMILES:
N[C@@H]1CCC[C@@H]1N.Cl.Cl
Properties
Complexity:
55.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
172.053g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
173.081g/mol
Monoisotopic Mass:
172.053g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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