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AG0033HM

Name: 3-Methylbut-2-enoic acid
Brand: Angene Chemical
SKU: AG0033HM

541-47-9 | 3-Methylbut-2-enoic acid

Chemical structure of 3-Methylbut-2-enoic acid, CAS 541-47-9

AG0033HM

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CAS Number	541-47-9
Catalog Number	AG0033HM(AGN-PC-0JK9RY)
Chemical Name	3-Methylbut-2-enoic acid
EC Number	208-782-7
FEMA Number	3187
IUPAC Name	3-methylbut-2-enoic acid
InChI	InChI=1S/C5H8O2/c1-4(2)3-5(6)7/h3H,1-2H3,(H,6,7)
InChI Key	YYPNJNDODFVZLE-UHFFFAOYSA-N
MDL Number	MFCD00004366
Molecular Formula	C5H8O2
Molecular Weight	100.1158
SMILES	CC(=CC(=O)O)C
UNII	EKV8I38F9I
Synonyms	beta,beta-dimethylacrylic acid, beta-methylcrotonic acid, senecioic acid, 3-methylbut-2-enoic acid, 3,3-Dimethylacrylic acid, 541-47-9, Senecioic acid, 3-Methylcrotonic acid, 3-METHYL-2-BUTENOIC ACID, 2-Butenoic acid, 3-methyl-, SENECIC ACID, beta,beta-Dimethylacrylic acid, Crotonic acid, 3-methyl-, beta,beta-Dimethacrylic acid, beta-Methylcrotonic acid, 3,3-Dimethyl acrylic acid, beta,beta-dimethyl acrylic acid, UNII-EKV8I38F9I, NSC 2549, Kyselina 3-methyl-2-butenova, FEMA No. 3187, EINECS 208-782-7, MFCD00004366, .beta.-Methylcrotonic acid, Kyselina 3-methyl-2-butenova [Czech], 3-methyl-but-2-enoic acid, BRN 1720305, EKV8I38F9I, AI3-23985, CHEBI:37127, NSC2549, .beta.,.beta.-Dimethacrylic acid, YYPNJNDODFVZLE-UHFFFAOYSA-N, .beta.,.beta.-Dimethylacrylic acid, LMFA01020097, 3-Methyl-2-butenoate, WLN: QV1UY1&1, F3308-0464, 3-methyl crotonic acid, senecate, Senecioate, b-Methylcrotonate, 3-Methylcrotonate, 3-methyl-crotonate, beta-methylcrotonate, dimethylacrylic acid, b,b-Dimethylacrylate, b-Methylcrotonic acid, 3,3-Dimethylacrylate, PubChem21295, 3-methyl-Crotonic acid, beta,beta-dimethacrylate, ACMC-209ldk, 3,3-dimethylacrylicacid, b,b-Dimethylacrylic acid, beta,beta-dimethylacrylate, beta-Methylcrotonic acid;, bmse000581, (CH3)2C=CHCOOH, EC 208-782-7, AC1Q2A1I, 3-methyl but-2-enoic acid, DSSTox_CID_27145, DSSTox_RID_82151, DSSTox_GSID_47145, SCHEMBL58395, 4-02-00-01555 (Beilstein Handbook Reference), KSC489O8J, 3-Methylbut-2-enoic acid #, AC1L1W98, CHEMBL115725, DTXSID2047145, SCHEMBL15940318, 38880_FLUKA, CTK3I9784, KS-00000CAF, 3,3-Dimethylacrylic acid, 97%, ZINC967396, BCP25289, NSC-2549, NSC97179, STR03265, Tox21_302475, ANW-31974, NSC-97179, SBB065769, AKOS002251011, CS-W011327, MCULE-4772426340, RP18692, RTR-019147, TRA0099150, NCGC00256890-01, AJ-24486, AK-65194, AN-21335, BC200231, CAS-541-47-9, LS-55597, SC-16257, DB-021811, ST2410795, TR-019147, FT-0616149, M0543, ST50207953, EN300-20709, M-6256, AE-848/32066036, I04-0251, Q-200334, Z955123734, InChI=1/C5H8O2/c1-4(2)3-5(6)7/h3H,1-2H3,(H,6,7, \|A-methylcrotonate, 3-methylbut-2-enoate, C5H8O2, C5-H8-O2, CID10931, 3,3',4',5,7-Pentahydroxyflavone, FA(5:1), 3,3-Dimethylacrylic acid, 98% - 25G 25g,

Complexity	98.6
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	100.052g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	100.117g/mol
Monoisotopic Mass	100.052g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.2

GHS Hazard and Precautionary Statements

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

Related Research Chemicals

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Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited