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159279-74-0 | Cyclopropanecarboxylic acid, 1-[(ethoxycarbonyl)amino]-2,2-dimethyl-
CAS No: 159279-74-0 Catalog No: AG001QL8 MDL No:
Product Description
Catalog Number:
AG001QL8
Chemical Name:
Cyclopropanecarboxylic acid, 1-[(ethoxycarbonyl)amino]-2,2-dimethyl-
CAS Number:
159279-74-0
Molecular Formula:
C9H15NO4
Molecular Weight:
201.2197
IUPAC Name:
1-(ethoxycarbonylamino)-2,2-dimethylcyclopropane-1-carboxylic acid
InChI:
InChI=1S/C9H15NO4/c1-4-14-7(13)10-9(6(11)12)5-8(9,2)3/h4-5H2,1-3H3,(H,10,13)(H,11,12)
InChI Key:
RLVICSYARRNXGI-UHFFFAOYSA-N
SMILES:
CCOC(=O)NC1(CC1(C)C)C(=O)O
Properties
Complexity:
274
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.1g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
201.222g/mol
Monoisotopic Mass:
201.1g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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