5-bromo-2-butoxyaniline

5-bromo-2-butoxyaniline

CAS: 946664-87-5

Formula: C10H14BrNO

SMILES: CCCCOC1=C(N)C=C(Br)C=C1

IUPAC: 5-bromo-2-butoxyaniline

InChI: InChI=1S/C10H14BrNO/c1-2-3-6-13-10-5-4-8(11)7-9(10)12/h4-5,7H,2-3,6,12H2,1H3

Composition: C (49.20%), H (5.78%), Br (32.73%), N (5.74%), O (6.55%)

Molar Mass: 244.132

Atom Count: 27

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	243.025877
Formal Charge	0
FSP3	0.4
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	GIGHUCFBZHSFLT-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	58.72
Topological Polar Surface Area	35.25
Polarizability	22.27
Ring Count	1
Rotatable Bond Count	4

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