200,000+ products from a single source!
sales@angenechem.com
165947-29-5 | Cyclohexanecarboxylic acid, 4-[[[(1,1-dimethylethoxy)carbonyl]methylamino]methyl]-, trans- (9CI)
CAS No: 165947-29-5 Catalog No: AG001WFE MDL No:MFCD06656432
Product Description
Catalog Number:
AG001WFE
Chemical Name:
Cyclohexanecarboxylic acid, 4-[[[(1,1-dimethylethoxy)carbonyl]methylamino]methyl]-, trans- (9CI)
CAS Number:
165947-29-5
Molecular Formula:
C14H25NO4
Molecular Weight:
271.3526
MDL Number:
MFCD06656432
IUPAC Name:
4-[[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]methyl]cyclohexane-1-carboxylic acid
InChI:
InChI=1S/C14H25NO4/c1-14(2,3)19-13(18)15(4)9-10-5-7-11(8-6-10)12(16)17/h10-11H,5-9H2,1-4H3,(H,16,17)
InChI Key:
HCDBMQKQNARMBU-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)CNC[C@@H]1CC[C@H](CC1)C(=O)O
Properties
Complexity:
327
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.178g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
271.357g/mol
Monoisotopic Mass:
271.178g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.