Home Other Building Blocks 2-(naphthalen-1-ylmethyl)succinic acid

2-(naphthalen-1-ylmethyl)succinic acid

CAS No.:
128318-37-6
Catalog Number:
AG01DHXF
Molecular Formula:
C15H14O4
Molecular Weight:
258.2693
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Product Description
Catalog Number:
AG01DHXF
Chemical Name:
2-(naphthalen-1-ylmethyl)succinic acid
CAS Number:
128318-37-6
Molecular Formula:
C15H14O4
Molecular Weight:
258.2693
IUPAC Name:
2-(naphthalen-1-ylmethyl)butanedioic acid
InChI:
InChI=1S/C15H14O4/c16-14(17)9-12(15(18)19)8-11-6-3-5-10-4-1-2-7-13(10)11/h1-7,12H,8-9H2,(H,16,17)(H,18,19)
InChI Key:
IAQHIBLUEJOQEX-UHFFFAOYSA-N
SMILES:
OC(=O)CC(C(=O)O)Cc1cccc2c1cccc2
Properties
Complexity:
339  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.089g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
258.273g/mol
Monoisotopic Mass:
258.089g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties