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1007-01-8 | Bicyclo[2.2.1]heptane-2-acetic acid
CAS No: 1007-01-8 Catalog No: AG0002NU MDL No:MFCD00167582
Product Description
Catalog Number:
AG0002NU
Chemical Name:
Bicyclo[2.2.1]heptane-2-acetic acid
CAS Number:
1007-01-8
Molecular Formula:
C9H14O2
Molecular Weight:
154.2063
MDL Number:
MFCD00167582
IUPAC Name:
2-(2-bicyclo[2.2.1]heptanyl)acetic acid
InChI:
InChI=1S/C9H14O2/c10-9(11)5-8-4-6-1-2-7(8)3-6/h6-8H,1-5H2,(H,10,11)
InChI Key:
FYHBMPWRHCWNBC-UHFFFAOYSA-N
SMILES:
OC(=O)CC1CC2CC1CC2
EC Number:
213-747-4
NSC Number:
174059
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.099g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
154.209g/mol
Monoisotopic Mass:
154.099g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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