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783285-04-1 | 1-Naphthaleneaceticacid, a-amino-2-hydroxy-
CAS No: 783285-04-1 Catalog No: AG0053PS MDL No:
Product Description
Catalog Number:
AG0053PS
Chemical Name:
1-Naphthaleneaceticacid, a-amino-2-hydroxy-
CAS Number:
783285-04-1
Molecular Formula:
C12H11NO3
Molecular Weight:
217.2206
IUPAC Name:
2-amino-2-(2-hydroxynaphthalen-1-yl)acetic acid
InChI:
InChI=1S/C12H11NO3/c13-11(12(15)16)10-8-4-2-1-3-7(8)5-6-9(10)14/h1-6,11,14H,13H2,(H,15,16)
InChI Key:
IJBVMBXKBDGZPQ-UHFFFAOYSA-N
SMILES:
OC(=O)C(c1c(O)ccc2c1cccc2)N
Properties
Complexity:
269
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.074g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
217.224g/mol
Monoisotopic Mass:
217.074g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
83.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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