7-(Ethylamino)-4-methylcoumarin

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Catalog Number
ACM28821183
Product Name
7-(Ethylamino)-4-methylcoumarin
Structure
Structure
CAS
28821-18-3
Category
Heterocyclic Organic Compound
IUPAC Name
7-(ethylamino)-4-methylchromen-2-one
Molecular Weight
203.24g/mol
Molecular Formula
C12H13NO2
Canonical SMILES
CCNC1=CC2=C(C=C1)C(=CC(=O)O2)C
InChI
InChI=1S/C12H13NO2/c1-3-13-9-4-5-10-8(2)6-12(14)15-11(10)7-9/h4-7,13H,3H2,1-2H3
InChI Key
OTNIKUTWXUODJZ-UHFFFAOYSA-N
Complexity
285
Covalently-Bonded Unit Count
1
EC Number
249-257-2
Exact Mass
203.094629g/mol
Formal Charge
0
H-Bond Acceptor
3
H-Bond Donor
1
Heavy Atom Count
15
Monoisotopic Mass
203.094629g/mol
Rotatable Bond Count
2
XLogP3
2.6
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