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1274936-94-5 | Carbamic acid, N-methyl-N-[4-(methylamino)cyclohexyl]-, 1,1-dimethylethyl ester
CAS No: 1274936-94-5 Catalog No: AG000X4E MDL No:MFCD21098112
Product Description
Catalog Number:
AG000X4E
Chemical Name:
Carbamic acid, N-methyl-N-[4-(methylamino)cyclohexyl]-, 1,1-dimethylethyl ester
CAS Number:
1274936-94-5
Molecular Formula:
C13H26N2O2
Molecular Weight:
242.3577
MDL Number:
MFCD21098112
IUPAC Name:
tert-butyl N-methyl-N-[4-(methylamino)cyclohexyl]carbamate
InChI:
InChI=1S/C13H26N2O2/c1-13(2,3)17-12(16)15(5)11-8-6-10(14-4)7-9-11/h10-11,14H,6-9H2,1-5H3
InChI Key:
UXCMOYRSKKQIHL-UHFFFAOYSA-N
SMILES:
CNC1CCC(CC1)N(C(=O)OC(C)(C)C)C
Properties
Complexity:
253
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.199g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
242.363g/mol
Monoisotopic Mass:
242.199g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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