Name: Name:4-Bromo-3-nitro-5-methoxytoluene
Brand: Angene
SKU: AG00IK4E
Rating: 90 (10 reviews)

4-Bromo-3-nitro-5-methoxytoluene

CAS No.:

98545-65-4

Catalog Number:

AG00IK4E

Molecular Formula:

C8H8BrNO3

Molecular Weight:

246.0580

Pack Size

Purity

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Price(USD)

Quantity

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United States

$577

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Catalog Number:

AG00IK4E

Chemical Name:

4-Bromo-3-nitro-5-methoxytoluene

CAS Number:

98545-65-4

Molecular Formula:

C8H8BrNO3

Molecular Weight:

246.0580

MDL Number:

MFCD18072853

IUPAC Name:

2-bromo-1-methoxy-5-methyl-3-nitrobenzene

InChI:

InChI=1S/C8H8BrNO3/c1-5-3-6(10(11)12)8(9)7(4-5)13-2/h3-4H,1-2H3

InChI Key:

NWEUWEZZJALKPB-UHFFFAOYSA-N

SMILES:

COc1cc(C)cc(c1Br)[N+](=O)[O-]

Complexity:

194

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

244.969g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

246.06g/mol

Monoisotopic Mass:

244.969g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.8