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2-(3-bromophenyl)-N'-hydroxyethanimidamide

2-(3-bromophenyl)-N'-hydroxyethanimidamide

CAS: 1016493-39-2

Formula: C8H9BrN2O

SMILES: NC(CC1=CC=CC(Br)=C1)=NO

IUPAC: 2-(3-bromophenyl)-N'-hydroxyethanimidamide

InChI: InChI=1S/C8H9BrN2O/c9-7-3-1-2-6(4-7)5-8(10)11-12/h1-4,12H,5H2,(H2,10,11)

Composition: C (41.95%), H (3.96%), Br (34.88%), N (12.23%), O (6.98%)

Molar Mass: 229.077

Atom Count: 21

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 227.989826
Formal Charge 0
FSP3 0.12
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey XCQACIIZCQFPRV-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 50.75
Topological Polar Surface Area 58.61
Polarizability 19.41
Ring Count 1
Rotatable Bond Count 2

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95% 1 Day 1016493-39-2 $129.74-$1,415.23$129.74$235.87$471.74$1,415.23
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