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885049-08-1

885049-08-1 | tert-Butyl 4-guanidinopiperidine-1-carboxylate hydrochloride

CAS No: 885049-08-1 Catalog No: AG00494N MDL No:MFCD09999149

Product Description

Catalog Number:
AG00494N
Chemical Name:
tert-Butyl 4-guanidinopiperidine-1-carboxylate hydrochloride
CAS Number:
885049-08-1
Molecular Formula:
C11H23ClN4O2
Molecular Weight:
278.7789
MDL Number:
MFCD09999149
IUPAC Name:
tert-butyl 4-(diaminomethylideneamino)piperidine-1-carboxylate;hydrochloride
InChI:
InChI=1S/C11H22N4O2.ClH/c1-11(2,3)17-10(16)15-6-4-8(5-7-15)14-9(12)13;/h8H,4-7H2,1-3H3,(H4,12,13,14);1H
InChI Key:
HYZASXQVPHIDOS-UHFFFAOYSA-N
SMILES:
O=C(N1CCC(CC1)NC(=N)N)OC(C)(C)C.Cl

Properties

Complexity:
297  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.151g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
278.781g/mol
Monoisotopic Mass:
278.151g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
93.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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