Name: Name:3-(5-METHYL-2-FURYL)ANILINE
Brand: Angene
SKU: AG00BX24
Rating: 90 (10 reviews)

3-(5-METHYL-2-FURYL)ANILINE

CAS No.:

306935-67-1

Catalog Number:

AG00BX24

Molecular Formula:

C11H11NO

Molecular Weight:

173.2111

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Product Description

Catalog Number:

AG00BX24

Chemical Name:

3-(5-METHYL-2-FURYL)ANILINE

CAS Number:

306935-67-1

Molecular Formula:

C11H11NO

Molecular Weight:

173.2111

MDL Number:

MFCD01126401

IUPAC Name:

3-(5-methylfuran-2-yl)aniline

InChI:

InChI=1S/C11H11NO/c1-8-5-6-11(13-8)9-3-2-4-10(12)7-9/h2-7H,12H2,1H3

InChI Key:

AYFFRNXUEKOLES-UHFFFAOYSA-N

SMILES:

Nc1cccc(c1)c1ccc(o1)C

Properties

Complexity:

172

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

173.084g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

173.215g/mol

Monoisotopic Mass:

173.084g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

39.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.4

Literature

Title	Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.	Bioorganic & medicinal chemistry letters 20101101

Properties