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251294-65-2 | Carbamic acid, N-(2-amino-2-iminoethyl)-, 1,1-dimethylethyl ester
CAS No: 251294-65-2 Catalog No: AG002QKE MDL No:
Product Description
Catalog Number:
AG002QKE
Chemical Name:
Carbamic acid, N-(2-amino-2-iminoethyl)-, 1,1-dimethylethyl ester
CAS Number:
251294-65-2
Molecular Formula:
C7H15N3O2
Molecular Weight:
173.2129
IUPAC Name:
tert-butyl N-(2-amino-2-iminoethyl)carbamate
InChI:
InChI=1S/C7H15N3O2/c1-7(2,3)12-6(11)10-4-5(8)9/h4H2,1-3H3,(H3,8,9)(H,10,11)
InChI Key:
SWBZVFFQFKRUQQ-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NCC(=N)N
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.116g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
173.216g/mol
Monoisotopic Mass:
173.116g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
88.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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