Home Other Building Blocks 2-{4-[(2,5-dioxoimidazolidin-4-yl)methyl]-1H-1,2,3-triazol-1-yl}acetic acid hydrochloride

2-{4-[(2,5-dioxoimidazolidin-4-yl)methyl]-1H-1,2,3-triazol-1-yl}acetic acid hydrochloride

CAS No.:
1786226-08-1
Catalog Number:
AG01BFAX
Molecular Formula:
C8H10ClN5O4
Molecular Weight:
275.6491
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Product Description
Catalog Number:
AG01BFAX
Chemical Name:
2-{4-[(2,5-dioxoimidazolidin-4-yl)methyl]-1H-1,2,3-triazol-1-yl}acetic acid hydrochloride
CAS Number:
1786226-08-1
Molecular Formula:
C8H10ClN5O4
Molecular Weight:
275.6491
MDL Number:
MFCD28118548
IUPAC Name:
2-[4-[(2,5-dioxoimidazolidin-4-yl)methyl]triazol-1-yl]acetic acid;hydrochloride
InChI:
InChI=1S/C8H9N5O4.ClH/c14-6(15)3-13-2-4(11-12-13)1-5-7(16)10-8(17)9-5;/h2,5H,1,3H2,(H,14,15)(H2,9,10,16,17);1H
InChI Key:
JTEYKIHFFNXWSX-UHFFFAOYSA-N
SMILES:
OC(=O)Cn1nnc(c1)CC1NC(=O)NC1=O.Cl
Properties
Complexity:
360  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
275.042g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
275.649g/mol
Monoisotopic Mass:
275.042g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
126A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties