Home Aminos tert-butyl N-{3-[(3,4-dimethylcyclohexyl)amino]propyl}carbamate hydrochloride

tert-butyl N-{3-[(3,4-dimethylcyclohexyl)amino]propyl}carbamate hydrochloride

CAS No.:
1803606-51-0
Catalog Number:
AG01BB4D
Molecular Formula:
C16H33ClN2O2
Molecular Weight:
320.8984
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Product Description
Catalog Number:
AG01BB4D
Chemical Name:
tert-butyl N-{3-[(3,4-dimethylcyclohexyl)amino]propyl}carbamate hydrochloride
CAS Number:
1803606-51-0
Molecular Formula:
C16H33ClN2O2
Molecular Weight:
320.8984
MDL Number:
MFCD28505872
IUPAC Name:
tert-butyl N-[3-[(3,4-dimethylcyclohexyl)amino]propyl]carbamate;hydrochloride
InChI:
InChI=1S/C16H32N2O2.ClH/c1-12-7-8-14(11-13(12)2)17-9-6-10-18-15(19)20-16(3,4)5;/h12-14,17H,6-11H2,1-5H3,(H,18,19);1H
InChI Key:
MMABHKZASNLMHK-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NCCCNC1CCC(C(C1)C)C.Cl
Properties
Complexity:
299  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
320.223g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
320.902g/mol
Monoisotopic Mass:
320.223g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
3  
Undefined Bond Stereocenter Count:
0
Properties