methyl 4-carbamimidoylbenzoate;hydrochloride


Chemical Name: methyl 4-carbamimidoylbenzoate;hydrochloride
CAS Number: 42823-73-4
Product Number: AG00COA8(AGN-PC-000RLB)
Synonyms:
MDL No: MFCD10697977
Molecular Formula: C9H11ClN2O2
Molecular Weight: 214.6488

Identification/Properties


Computed Properties
Molecular Weight:
214.649g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
214.051g/mol
Monoisotopic Mass:
214.051g/mol
Topological Polar Surface Area:
76.2A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
208
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
2
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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