1-(4-amino-3-nitrophenyl)propan-2-ol

1-(4-amino-3-nitrophenyl)propan-2-ol

CAS: 855444-70-1

Formula: C9H12N2O3

SMILES: CC(O)CC1=CC=C(N)C(=C1)[N+]([O-])=O

IUPAC: 1-(4-amino-3-nitrophenyl)propan-2-ol

InChI: InChI=1/C9H12N2O3/c1-6(12)4-7-2-3-8(10)9(5-7)11(13)14/h2-3,5-6,12H,4,10H2,1H3

Composition: C (55.09%), H (6.16%), N (14.28%), O (24.46%)

Molar Mass: 196.206

Atom Count: 26

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	196.084792254
Formal Charge	0
FSP3	0.33
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	XSZCJEDTVDAWSC-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	53.07
Topological Polar Surface Area	89.39
Polarizability	19.44
Ring Count	1
Rotatable Bond Count	3

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<5 Days	855444-70-1		$45.40-$208.07$45.40$78.18$208.07