AG00HT96

13419-69-7 | 2-Hexenoic acid, (2E)-

AG00HT96

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CAS Number	13419-69-7
Catalog Number	AG00HT96(AGN-PC-0O15FD)
Chemical Name	2-Hexenoic acid, (2E)-
FEMA Number	3169
IUPAC Name	(E)-hex-2-enoic acid
InChI	InChI=1S/C6H10O2/c1-2-3-4-5-6(7)8/h4-5H,2-3H2,1H3,(H,7,8)/b5-4+
InChI Key	NIONDZDPPYHYKY-SNAWJCMRSA-N
MDL Number	MFCD00002705
Molecular Formula	C6H10O2
Molecular Weight	114.1424
SMILES	CCCC=CC(O)=O
UNII	VQ24908VRU
Synonyms	trans-2-Hexenoic acid, 2-HEXENOIC ACID, 13419-69-7, (E)-hex-2-enoic acid, hex-2-enoic acid, 2-Hexenoic acid, (2E)-, 1191-04-4, Hexenoic acid, (E)-2-Hexenoic acid, (2E)-hex-2-enoic acid, 2-Hexenoic acid, (E)-, trans-Hex-2-enoic acid, 2E-hexenoic acid, Isohydrosorbic acid, UNII-VQ24908VRU, 2-Hexenoic acid, trans-, (2E)-HEXENOIC ACID, VQ24908VRU, CHEBI:87721, NIONDZDPPYHYKY-SNAWJCMRSA-N, MFCD00002705, 3-Propylacrylic acid, Propylacrylic acid, beta-, C6:1n-4, FEMA No. 3169, 2-hexenoic acids, Hex-2-ensaeure, 2-?Hexenoic acid, hex-2-enoic acids, (E)-hexenoic acid, EINECS 214-727-8, EINECS 236-528-5, alpha.beta-Hexensaeure, beta-propylacrylic acid, alpha,beta-hexenoic acid, beta-propyl acrylic acid, AI3-36119, (2E)hex-2-enoic acid, AC1NR0MC, AC1Q2SNQ, SCHEMBL23614, SCHEMBL23615, trans-2-Hexenoic acid, 99%, QSPL 013, CHEMBL2252747, DTXSID5061588, CHEBI:61206, NIONDZDPPYHYKY-SNAWJCMRSA-, ZINC1850698, CT0206, LMFA01030008, SBB009088, AKOS000121254, C6:1, n-4, CS-W011247, NE10216, RTR-004625, trans-2-Hexenoic acid, >=98%, FG, 1289-40-3, AJ-32059, AN-19581, SC-39942, DB-002108, TR-004625, Y5070, Q-103481, UNII-BXY1L20879 component NIONDZDPPYHYKY-SNAWJCMRSA-N, InChI=1/C6H10O2/c1-2-3-4-5-6(7)8/h4-5H,2-3H2,1H3,(H,7,8)/b5-4+, trans-2-hexenoicacid, (2E)-2-Hexenoic acid, 2-Hexenoic acid, (E )-, UNII-BXY1L20879, C6H10O2, 1-Decanesulfonic acid sodium salt, BXY1L20879, C6-H10-O2, CID5282707, FA(6:1), H0383, trans-2-Hexenoic acid, 98% - 10G 10g,

Complexity	94.7
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Exact Mass	114.068g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	114.144g/mol
Monoisotopic Mass	114.068g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H302-H315-H319-H335
Packing Group	Ⅱ
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
Signal Words	warning
UN Code	UN 3261

Certificate of Analysis

Lot Number