Home Carboxys 1-(((benzyloxy)carbonyl)amino)-2,2-dimethylcyclopentanecarboxylic acid

1-(((benzyloxy)carbonyl)amino)-2,2-dimethylcyclopentanecarboxylic acid

CAS No.:
1518841-50-3
Catalog Number:
AG01DVI9
Molecular Formula:
C16H21NO4
Molecular Weight:
291.3422
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Product Description
Catalog Number:
AG01DVI9
Chemical Name:
1-(((benzyloxy)carbonyl)amino)-2,2-dimethylcyclopentanecarboxylic acid
CAS Number:
1518841-50-3
Molecular Formula:
C16H21NO4
Molecular Weight:
291.3422
MDL Number:
MFCD31616092
IUPAC Name:
2,2-dimethyl-1-(phenylmethoxycarbonylamino)cyclopentane-1-carboxylic acid
InChI:
InChI=1S/C16H21NO4/c1-15(2)9-6-10-16(15,13(18)19)17-14(20)21-11-12-7-4-3-5-8-12/h3-5,7-8H,6,9-11H2,1-2H3,(H,17,20)(H,18,19)
InChI Key:
SRPHQHUFBPQJHA-UHFFFAOYSA-N
SMILES:
O=C(NC1(CCCC1(C)C)C(=O)O)OCc1ccccc1
Properties
Complexity:
401  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.147g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
291.347g/mol
Monoisotopic Mass:
291.147g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties