Name: Name:7-chloro-6-methyl-2H-1,4-benzoxazin-3(4H)-one
Brand: Angene
SKU: AG008V3W
Rating: 90 (10 reviews)

7-chloro-6-methyl-2H-1,4-benzoxazin-3(4H)-one

CAS No.:

1185320-25-5

Catalog Number:

AG008V3W

Molecular Formula:

C9H8ClNO2

Molecular Weight:

197.6183

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Purity

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Price(USD)

Quantity

95%

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United States

$168

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Catalog Number:

AG008V3W

Chemical Name:

7-chloro-6-methyl-2H-1,4-benzoxazin-3(4H)-one

CAS Number:

1185320-25-5

Molecular Formula:

C9H8ClNO2

Molecular Weight:

197.6183

MDL Number:

MFCD12827490

IUPAC Name:

7-chloro-6-methyl-4H-1,4-benzoxazin-3-one

InChI:

InChI=1S/C9H8ClNO2/c1-5-2-7-8(3-6(5)10)13-4-9(12)11-7/h2-3H,4H2,1H3,(H,11,12)

InChI Key:

ILBVDYONJMQLQR-UHFFFAOYSA-N

SMILES:

O=C1COc2c(N1)cc(c(c2)Cl)C

Complexity:

222

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

197.024g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

197.618g/mol

Monoisotopic Mass:

197.024g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

38.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.9