4-(hydroxymethyl)-2-nitrophenol

4-(hydroxymethyl)-2-nitrophenol

CAS: 41833-13-0

Formula: C7H7NO4

SMILES: OCC1=CC(=C(O)C=C1)[N+]([O-])=O

IUPAC: 4-(hydroxymethyl)-2-nitrophenol

InChI: InChI=1S/C7H7NO4/c9-4-5-1-2-7(10)6(3-5)8(11)12/h1-3,9-10H,4H2

Composition: C (49.71%), H (4.17%), N (8.28%), O (37.84%)

Molar Mass: 169.136

Atom Count: 19

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	169.037507709
Formal Charge	0
FSP3	0.14
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	IMLGJYRKLCMJPI-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	41.18
Topological Polar Surface Area	83.6
Polarizability	15.36
Ring Count	1
Rotatable Bond Count	2

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