AG00IKJI

1126-74-5 | 2-Propenoic acid, 3-(3-pyridinyl)-

AG00IKJI

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CAS Number	1126-74-5
Catalog Number	AG00IKJI(AGN-PC-04VXTJ)
Chemical Name	2-Propenoic acid, 3-(3-pyridinyl)-
IUPAC Name	(E)-3-pyridin-3-ylprop-2-enoic acid
InChI	InChI=1S/C8H7NO2/c10-8(11)4-3-7-2-1-5-9-6-7/h1-6H,(H,10,11)/b4-3+
InChI Key	VUVORVXMOLQFMO-ONEGZZNKSA-N
MDL Number	MFCD00006410
Molecular Formula	C8H7NO2
Molecular Weight	149.1467
SMILES	O=C(O)/C=C/C1=CC=CN=C1
Synonyms	3-(3-Pyridyl)acrylic acid, 1126-74-5, 19337-97-4, trans-3-(3-Pyridyl)acrylic acid, (E)-3-(pyridin-3-yl)acrylic acid, 3-Pyridylacrylic acid, (2E)-3-pyridin-3-ylacrylic acid, Trans-3-(3'-Pyridyl)acrylic acid, 3-(Pyridin-3-yl)acrylic acid, (2E)-3-(pyridin-3-yl)prop-2-enoic acid, MFCD00006410, 3-Pyridineacrylic acid, 3-(3-pyridinyl)acrylic acid, 3-PYRIDINYL-ACRYLIC ACID, (E)-3-(3-pyridyl)acrylic acid, VUVORVXMOLQFMO-ONEGZZNKSA-N, 3-(pyridin-3-yl)prop-2-enoic acid, (E)-3-pyridin-3-ylprop-2-enoic acid, 2-Propenoic acid, 3-(3-pyridinyl)-, (2E)-3-(3-pyridyl)prop-2-enoic acid, 3-pyridin-3-ylacrylic acid, 3-(3-Pyridyl)propenoic acid, (2e)-3-(3-pyridinyl)acrylic acid, trans-3-Pyridineacrylic acid, EINECS 214-424-0, PubChem3816, AC1LFDMZ, PubChem16731, AC1Q5RAY, 3-(3-Pyridyl)acrylicacid, AC1Q71IW, 3-(3-Pyridine)acrylic acid, MLS000673854, SCHEMBL334614, CHEMBL1771759, E-3-(3-pyridyl)propenoic acid, .beta.-(3-Pyridyl)acrylic acid, VUVORVXMOLQFMO-ONEGZZNKSA-, HMS1648F01, HMS2744N23, ZINC266005, (E)-3-pyridin-3-yl-acrylic acid, trans-3-(3-pyridyl) acrylic acid, trans-3-(3-pyridyl)-acrylic acid, ACT07844, ALBB-007463, BCP27261, STR09431, BBL004476, CP-441, SBB028467, STK500532, AKOS000263332, AKOS023552662, LS20492, PS-4718, RP01615, RTC-070745, (2E)-3-(3-pyridyl)-2-propenoic acid, NCGC00245962-01, trans-3-(3-Pyridyl)acrylic acid, 99%, AJ-18586, BC204442, BC630675, SC-39941, SC-57973, SMR000315095, U931, (2E)-3-(3-Pyridinyl)-2-propenoic acid, AB0019559, TC-070745, TC-163603, TL8000367, CS-0031477, FT-0083607, P1157, ST24028355, ST50307857, Y8120, (2E)-3-(3-Pyridinyl)-2-propenoic acid #, EN300-27847, W-6186, 2-Propenoic acid, 3-(3-pyridinyl)-, (2E)-, I04-0143, W-206427, I14-86207, F0917-7548, trans-3-(3-Pyridyl)acrylic acid, purum, >=98.0% (T), InChI=1/C8H7NO2/c10-8(11)4-3-7-2-1-5-9-6-7/h1-6H,(H,10,11)/b4-3+, C8H7NO2, C8-H7-N-O2, KST-1A2426, (2e)-3-pyridin-4-ylacrylic acid, (E)-3-(Pyridin-3-yl)acrylicacid, AR-1A2311, CID776396, (E)-3-(Pyridin-3-yl) acrylic acid, ACN-042101, 3-(3-Pyridyl)acrylic acid, 98% - 25G 25g, trans-3-(3-Pyridyl)acrylic acid, 99% - 25G 25g, 19423-76-8, 36215-07-3,

Complexity	166
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Exact Mass	149.048g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	149.149g/mol
Monoisotopic Mass	149.048g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	50.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
Signal Words	warning
UN Code

Certificate of Analysis

Lot Number