200,000+ products from a single source!
sales@angenechem.com
Home > Carboxes > 1257398-12-1
1257398-12-1 | Cyclobutanecarboxylic acid, 1-(3-hydroxyphenyl)-, methyl ester
CAS No: 1257398-12-1 Catalog No: AG000OLD MDL No:MFCD15071136
Product Description
Catalog Number:
AG000OLD
Chemical Name:
Cyclobutanecarboxylic acid, 1-(3-hydroxyphenyl)-, methyl ester
CAS Number:
1257398-12-1
Molecular Formula:
C12H14O3
Molecular Weight:
206.2378
MDL Number:
MFCD15071136
IUPAC Name:
methyl 1-(3-hydroxyphenyl)cyclobutane-1-carboxylate
InChI:
InChI=1S/C12H14O3/c1-15-11(14)12(6-3-7-12)9-4-2-5-10(13)8-9/h2,4-5,8,13H,3,6-7H2,1H3
InChI Key:
UJSYXDNHFIRGMM-UHFFFAOYSA-N
SMILES:
COC(=O)C1(CCC1)c1cccc(c1)O
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.094g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
206.241g/mol
Monoisotopic Mass:
206.094g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.