Home Other Building Blocks tert-butyl N-(1-carbamimidoylethyl)carbamate hydrochloride

tert-butyl N-(1-carbamimidoylethyl)carbamate hydrochloride

CAS No.:
1330180-06-7
Catalog Number:
AG01C2SK
Molecular Formula:
C8H18ClN3O2
Molecular Weight:
223.7004
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Product Description
Catalog Number:
AG01C2SK
Chemical Name:
tert-butyl N-(1-carbamimidoylethyl)carbamate hydrochloride
CAS Number:
1330180-06-7
Molecular Formula:
C8H18ClN3O2
Molecular Weight:
223.7004
MDL Number:
MFCD14696675
IUPAC Name:
tert-butyl N-(1-amino-1-iminopropan-2-yl)carbamate;hydrochloride
InChI:
InChI=1S/C8H17N3O2.ClH/c1-5(6(9)10)11-7(12)13-8(2,3)4;/h5H,1-4H3,(H3,9,10)(H,11,12);1H
InChI Key:
LYBYSYDYQLVOFF-UHFFFAOYSA-N
SMILES:
CC(C(=N)N)NC(=O)OC(C)(C)C.Cl
Properties
Complexity:
208  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.109g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
223.701g/mol
Monoisotopic Mass:
223.109g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
88.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties