AG0027A7

1798-11-4 | Acetic acid, 2-(4-nitrophenoxy)-

AG0027A7

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CAS Number	1798-11-4
Catalog Number	AG0027A7(AGN-PC-0JKCGM)
Chemical Name	Acetic acid, 2-(4-nitrophenoxy)-
EC Number	217-283-3
IUPAC Name	2-(4-nitrophenoxy)acetic acid
InChI	InChI=1S/C8H7NO5/c10-8(11)5-14-7-3-1-6(2-4-7)9(12)13/h1-4H,5H2,(H,10,11)
InChI Key	AVDLFIONKHGQAP-UHFFFAOYSA-N
MDL Number	MFCD00017030
Molecular Formula	C8H7NO5
Molecular Weight	197.1449
NSC Number	166278
SMILES	OC(COC1=CC=C([N+]([O-])=O)C=C1)=O
Synonyms	(4-nitrophenoxy)acetic acid, 1798-11-4, 2-(4-Nitrophenoxy)acetic acid, 4-Nitrophenoxyacetic acid, (4-Nitrophenoxy)acetic acid, p-Nitrophenoxyacetic acid, (4-Nitro-phenoxy)-acetic acid, Acetic acid, (4-nitrophenoxy)-, Ba 2690, Acetic acid, 2-(4-nitrophenoxy)-, ACETIC ACID, p-NITROPHENOXY-, EINECS 217-283-3, NSC 166278, BRN 2051970, AI3-52610, AVDLFIONKHGQAP-UHFFFAOYSA-N, ACMC-209efx, 4-nitrophenoxy acetic acid, AC1L26HF, Oprea1_291146, (4-nitrophenoxy) acetic acid, (4-nitrophenoxy)-acetic acid, 4-06-00-01302 (Beilstein Handbook Reference), SCHEMBL656493, (4-Nitro phenoxy)acetic Acid, (4-Nitro phenoxy) acetic acid, AC1Q765M, ARONIS023189, CHEMBL177045, Jsp003701, Acetic acid, (p-nitrophenoxy)-, DTXSID3061978, CTK3J3514, ZINC78021, 2-(4-nitro-phenoxy)-acetic acid, Ba-2690, ALBB-000229, KS-00004E9B, ANW-22987, BBL023111, MFCD00017030, NSC166278, SBB000363, STK093391, AKOS000264482, MCULE-4354028178, NSC-166278, RTR-049559, VZ29556, AJ-10426, AM100400, AN-49909, I558, LS-12604, ST012638, ST2403979, TR-049559, 4CH-018689, FT-0689255, N0226, A-8201, AF-615/00098055, SR-01000409228, SR-01000409228-1, W-107813, I14-45124, Z56347386, (4-nitrophenoxy)acetic acid - 2,2',2''-nitrilotriethanol (1:1), C8H7NO5, 2-(4-Nitrophenoxy)aceticacid, C8-H7-N-O5, CID15720,

Complexity	216
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	197.032g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	197.146g/mol
Monoisotopic Mass	197.032g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	92.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H315-H319
Precuationary statements	P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
Siginal words

Certificate of Analysis

Lot Number