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Home Aminos (3-Dimethylaminomethylene-4-oxo-cyclohexyl)-carbamic acid tert-butyl ester

(3-Dimethylaminomethylene-4-oxo-cyclohexyl)-carbamic acid tert-butyl ester

CAS No.:
1171130-67-8
Catalog Number:
AG0093KP
Molecular Formula:
C14H24N2O3
Molecular Weight:
268.3520
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$207
- +
5g
95%
In Stock USA
United States
$725
- +
10g
95%
In Stock USA
United States
$1206
- +
Product Description
Catalog Number:
AG0093KP
Chemical Name:
(3-Dimethylaminomethylene-4-oxo-cyclohexyl)-carbamic acid tert-butyl ester
CAS Number:
1171130-67-8
Molecular Formula:
C14H24N2O3
Molecular Weight:
268.3520
MDL Number:
MFCD24843137
IUPAC Name:
tert-butyl N-[(3Z)-3-(dimethylaminomethylidene)-4-oxocyclohexyl]carbamate
InChI:
InChI=1S/C14H24N2O3/c1-14(2,3)19-13(18)15-11-6-7-12(17)10(8-11)9-16(4)5/h9,11H,6-8H2,1-5H3,(H,15,18)/b10-9-
InChI Key:
JYWATPVKXAPTLI-KTKRTIGZSA-N
SMILES:
O=C(OC(C)(C)C)NC1CCC(=O)/C(=C\N(C)C)/C1
Properties
Complexity:
381  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
268.179g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
268.357g/mol
Monoisotopic Mass:
268.179g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties