AG01E5PW

394-34-3 | 2-Fluoro-4-Hydroxy-5-Nitrobenzaldehyde

AG01E5PW

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CAS Number	394-34-3
Catalog Number	AG01E5PW(AGN-PC-0WOMV3)
Chemical Name	2-Fluoro-4-Hydroxy-5-Nitrobenzaldehyde
IUPAC Name	2-fluoro-4-hydroxy-5-nitrobenzaldehyde
InChI	InChI=1S/C7H4FNO4/c8-5-2-7(11)6(9(12)13)1-4(5)3-10/h1-3,11H
InChI Key	OKOHNWCMTKVWQB-UHFFFAOYSA-N
MDL Number	MFCD27995610
Molecular Formula	C7H4FNO4
Molecular Weight	185.1094
SMILES	O=CC1=CC([N+]([O-])=O)=C(O)C=C1F
Synonyms	2-fluoro-4-hydroxy-5-nitrobenzaldehyde, 394-34-3, SCHEMBL532044, OKOHNWCMTKVWQB-UHFFFAOYSA-N, MFCD27995610, ZINC97447140, AKOS027384881, FCH3820902, 2-fluoro-4-hydroxy-5-nitro-benzaldehyde, PC500450,

Complexity	217
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	185.012g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	185.11g/mol
Monoisotopic Mass	185.012g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	83.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H301-H311-H331
Packing Group	Ⅲ
Precautionary statements	P261-P264-P270-P271-P280-P302+P352-P304+P340-P310-P330-P361-P403+P233-P405-P501
UN Code	UN 2811

Certificate of Analysis

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