AG00IKHC

612-41-9 | 2-Propenoic acid, 3-(nitrophenyl)-

AG00IKHC

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CAS Number	612-41-9
Catalog Number	AG00IKHC(AGN-PC-0JLZUI)
Chemical Name	2-Propenoic acid, 3-(nitrophenyl)-
EC Number	210-309-4
IUPAC Name	(E)-3-(2-nitrophenyl)prop-2-enoic acid
InChI	InChI=1S/C9H7NO4/c11-9(12)6-5-7-3-1-2-4-8(7)10(13)14/h1-6H,(H,11,12)/b6-5+
InChI Key	BBQDLDVSEDAYAA-AATRIKPKSA-N
MDL Number	MFCD00007189
Molecular Formula	C9H7NO4
Molecular Weight	193.1562
SMILES	O=C(O)C=CC1=CC=CC=C1[N+]([O-])=O
Synonyms	2-Nitrocinnamic acid, 612-41-9, o-Nitrocinnamic acid, 1013-96-3, 3-(2-nitrophenyl)acrylic acid, (E)-3-(2-Nitrophenyl)acrylic acid, Cinnamic acid, o-nitro-, trans-2-Nitrocinnamic acid, 2-Propenoic acid, 3-(2-nitrophenyl)-, 3-(2-Nitrophenyl)-acrylic acid, (2E)-3-(2-nitrophenyl)prop-2-enoic acid, CCRIS 1668, 3-(2-Nitrophenyl)propenoic acid, EINECS 210-309-4, NSC 14018, 3-(2-Nitrophenyl)-2-propenoic acid, 2-Propenoic acid, 3-(2-nitrophenyl)-, (2E)-, (E)-3-(2-nitrophenyl)prop-2-enoic acid, Cinnamic acid, o-nitro- (6CI,7CI,8CI), BBQDLDVSEDAYAA-AATRIKPKSA-N, 2-NitrocinnamicAcid, MFCD00007189, NSC638145, (2E)-3-(2-nitrophenyl)acrylic acid, J-501880, CCRIS 2339, o-Nitrozimtsaure, PubChem8219, AC1LEGYC, AC1Q5AUN, AC1Q71EU, SCHEMBL42323, MLS000775419, ARONIS23738, AC1Q204A, ARONIS023793, CHEMBL1565279, BBQDLDVSEDAYAA-AATRIKPKSA-, BBB/995, HMS2742K24, trans-2-Nitrocinnamic acid, 98%, ZINC154472, ACN-S004268, ACT03662, ALBB-011739, E-3-(2-nitrophenyl)propenoic acid, NSC14018, ZX-AN010556, ZX-AS004220, ZX-AT009331, BBL015183, NSC-14018, OR6581, SBB028517, STK414988, AKOS000120412, trans-3-(2-nitrophenyl)propenoic acid, AS-9704, FCH2251700, FCH3684741, NSC-638145, RP17473, RTR-037274, NCGC00246152-01, AC-20109, AJ-13238, AK116662, BBV-39824104, SC-81155, SMR000368499, AB0065098, AX8007489, AX8077712, BB0257993, LS-123736, LS-190729, ST2417349, TR-037274, BB 0257993, N0356, ST45025003, (2E)-3-(2-Nitrophenyl)-2-propenoic acid #, 3-(2-(Hydroxy(oxido)amino)phenyl)acrylic acid, B-6250, I04-13671, F1727-0301, InChI=1/C9H7NO4/c11-9(12)6-5-7-3-1-2-4-8(7)10(13)14/h1-6H,(H,11,12)/b6-5+, Cinnamic acid, o-nitro-, (E)-, C9-H7-N-O4, AR-1E6394, AR-1I2354, CID735923, 3-(2-nitrophenyl)prop-2-enoic acid, 2-Propenoic acid, 3-(2-nitrophenyl)-, (E)-, trans-2-Nitrocinnamic acid, 98% - 100G 100g, 616-99-9, 62718-31-4,

Complexity	256
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Exact Mass	193.038g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	193.158g/mol
Monoisotopic Mass	193.038g/mol
Rotatable Bond Count	2
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 statements	H315-H319-H335
Precuationary statements	P261-P305+P351+P338
Siginal words

Certificate of Analysis

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