AG001NPS

1552-96-1 | 2-Propenoic acid, 3-[4-(dimethylamino)phenyl]-

AG001NPS

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CAS Number	1552-96-1
Catalog Number	AG001NPS(AGN-PC-0JLB6P)
Chemical Name	2-Propenoic acid, 3-[4-(dimethylamino)phenyl]-
EC Number	216-299-8
IUPAC Name	(E)-3-[4-(dimethylamino)phenyl]prop-2-enoic acid
InChI	InChI=1S/C11H13NO2/c1-12(2)10-6-3-9(4-7-10)5-8-11(13)14/h3-8H,1-2H3,(H,13,14)/b8-5+
InChI Key	CQNPVMCASGWEHM-VMPITWQZSA-N
MDL Number	MFCD11976260
Molecular Formula	C11H13NO2
Molecular Weight	191.2264
SMILES	O=C(O)/C=C/C1=CC=C(N(C)C)C=C1
Synonyms	4-(dimethylamino)cinnamic acid, 4-(Dimethylamino)cinnamic acid, 1552-96-1, 4-dimethylaminocinnamic acid, p-(Dimethylamino)cinnamic acid, 3-(4-(Dimethylamino)phenyl)acrylic acid, 4-(N,N-Dimethylamino)cinnamic acid, MFCD00004397, 4-Dimethylamino cinnamic acid, CQNPVMCASGWEHM-VMPITWQZSA-N, 4-(n,n-dimethyamino)cinnamic acid, (2E)-3-[4-(dimethylamino)phenyl]prop-2-enoic acid, NSC638140, 4-(Dimethylamino)cinnamic acid, 99%, 3-[4-(dimethylamino)phenyl]acrylic acid, (e)-3-(4-(dimethylamino)phenyl)acrylic acid, (E)-3-(4-dimethylaminophenyl)prop-2-enoic acid, NSC643350, (E)-3-[4-(dimethylamino)phenyl]acrylic acid, p-Dimethylaminocinnamic acid, sodium salt, EINECS 216-299-8, PubChem8236, 3-[4-(dimethylamino)phenyl]prop-2-enoic acid, AC1LTUVY, AI3-62575, Dimethylaminocinnamic acid, p-dimethylaminocinnamic acid, Jsp003040, CHEMBL1771755, p-n,n-dimethylaminocinnamic acid, 4-(Dimethylamino)Cinnamic Acid., 4-(N-Dimethylamino)cinnamic acid, 4-(N,N-Dimethamino)cinnamic acid, NSC13673, ZINC1471033, GEO-01146, NSC-13673, SBB063891, AKOS000263375, NSC-638140, RTR-006490, 3-(p-(Dimethylamino)phenyl)acrylic acid, AJ-26267, AN-49429, CC-16877, SC-42011, AB0008341, TR-006490, ST24041448, ST45169471, M-2387, 3-[4-(Dimethylamino)phenyl]-2-propenoic acid #, AE-641/05563006, C-08272, (E)-3-[4-(dimethylamino)phenyl]prop-2-enoic acid, I01-3219, W-108022, 5676-65-3, C11H13NO2, C11-H13-N-O2, CID1540638, 2-Propenoic acid, 3-(4-(dimethylamino)phenyl)-, 2-Propenoic acid, 3-[4-(dimethylamino)phenyl]-,

Complexity	215
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Exact Mass	191.095g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	191.23g/mol
Monoisotopic Mass	191.095g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	40.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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