3-chloro-4-propan-2-yloxyaniline;hydrochloride


Chemical Name: 3-chloro-4-propan-2-yloxyaniline;hydrochloride
CAS Number: 35594-48-0
Product Number: AG00C6KV(AGN-PC-06D86V)
Synonyms:
MDL No: MFCD10666930
Molecular Formula: C9H13Cl2NO
Molecular Weight: 222.1116

Identification/Properties


Computed Properties
Molecular Weight:
222.109g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
2
Exact Mass:
221.037g/mol
Monoisotopic Mass:
221.037g/mol
Topological Polar Surface Area:
35.2A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
141
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#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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