Home Carboxys 3-[1-(hydroxyimino)ethyl]-2,2-dimethylcyclobutane-1-carboxylic acid

3-[1-(hydroxyimino)ethyl]-2,2-dimethylcyclobutane-1-carboxylic acid

CAS No.:
1379427-51-6
Catalog Number:
AG01AF6G
Molecular Formula:
C9H15NO3
Molecular Weight:
185.2203
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Product Description
Catalog Number:
AG01AF6G
Chemical Name:
3-[1-(hydroxyimino)ethyl]-2,2-dimethylcyclobutane-1-carboxylic acid
CAS Number:
1379427-51-6
Molecular Formula:
C9H15NO3
Molecular Weight:
185.2203
MDL Number:
MFCD29906752
IUPAC Name:
3-[(E)-N-hydroxy-C-methylcarbonimidoyl]-2,2-dimethylcyclobutane-1-carboxylic acid
InChI:
InChI=1S/C9H15NO3/c1-5(10-13)6-4-7(8(11)12)9(6,2)3/h6-7,13H,4H2,1-3H3,(H,11,12)/b10-5+
InChI Key:
YOIRZJVLRCWQHH-BJMVGYQFSA-N
SMILES:
ON=C(C1CC(C1(C)C)C(=O)O)C
Properties
Complexity:
258  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
185.105g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
185.223g/mol
Monoisotopic Mass:
185.105g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
69.9A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties