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6-mnaa

6-mnaa

CAS: 23981-47-7

Formula: C13H12O3

SMILES: COC1=CC=C2C=C(CC(O)=O)C=CC2=C1

IUPAC: 2-(6-methoxynaphthalen-2-yl)acetic acid

InChI: InChI=1S/C13H12O3/c1-16-12-5-4-10-6-9(7-13(14)15)2-3-11(10)8-12/h2-6,8H,7H2,1H3,(H,14,15)

Composition: C (72.21%), H (5.59%), O (22.20%)

Molar Mass: 216.236

Atom Count: 28

Heavy Atom Count: 16

Properties
Properties
Common Names 6-metossi-2-naphtil acetico; 6-mnaa
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 216.078644246
Formal Charge 0
FSP3 0.15
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey PHJFLPMVEFKEPL-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 60.28
Topological Polar Surface Area 46.53
Polarizability 24.54
Ring Count 2
Rotatable Bond Count 3

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