AG001IQY

144-90-1 | DL-3-aminoisobutyric acid hydrate

AG001IQY

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CAS Number	144-90-1
Catalog Number	AG001IQY(AGN-PC-0JL6II)
Chemical Name	DL-3-aminoisobutyric acid hydrate
EC Number	205-644-8
IUPAC Name	3-amino-2-methylpropanoic acid
InChI	InChI=1S/C4H9NO2/c1-3(2-5)4(6)7/h3H,2,5H2,1H3,(H,6,7)
InChI Key	QCHPKSFMDHPSNR-UHFFFAOYSA-N
MDL Number	MFCD00008145
Molecular Formula	C4H9NO2
Molecular Weight	103.1198
SMILES	O=C(O)C(C)CN
Synonyms	3-aminoisobutyric acid, 3-aminoisobutyric acid, (+-)-isomer, 3-aminoisobutyric acid, (R)-isomer, 3-aminoisobutyric acid, (S)-isomer, 3-aminoisobutyric acid, tritium-labeled, beta-aminoisobutyric acid, DL-3-aminoisobutyric acid monohydrate, dl-3-Aminoisobutyric acid, 3-amino-2-methylpropanoic acid, 144-90-1, 3-Aminoisobutyric acid, 10569-72-9, dl-beta-Aminoisobutyric acid, beta-Aminoisobutyric acid, 3-Aminoisobutanoate, Propanoic acid, 3-amino-2-methyl-, dl-3-Amino-2-methylpropionic acid, alpha-Methyl-beta-alanine, 3-Amino-2-methylpropanoate, 2-(Aminomethyl)propionic acid, 2-Methyl-beta-alanine, 3-amino-isobutanoic acid, 3-aminoisobutyrate, BAIB, dl-.beta.-Aminoisobutyric acid, 3-Aminoisobutanoic acid, EINECS 205-644-8, DL-2-Methyl-beta-alanine, Isobutanoic acid, 3-amino-, 3-Amino-2-methylpropionic acid, (+/-)-3-Aminoisobutyric acid, 3-amino-3-methyl-propionic acid, CHEBI:27389, (+/-)-beta-Aminoisobutyric acid, QCHPKSFMDHPSNR-UHFFFAOYSA-N, MFCD00008145, (+/-)-3-Amino-2-methylpropanoic acid, a-Methyl-b-alanine, EINECS 234-154-7, (1)-3-Amino-2-methylpropionic acid, 2-Methyl-b-alanine, BAIBA, 3-Amino-isobutanoate, b-Aminoisobutyric acid, 2-Methylalanine; Aib, PubChem21922, DL-2-Methyl-b-alanine, beta-amino-isobutyric acid, bmse000828, H-(ME)ALA-OH, H-ALA(ME)-OH, .beta.-Aminoisobutyric acid, AC1L22AH, DL-|A-Aminoisobutyric acid, SCHEMBL2191, H-ALPHA-METHYLALANINE, (+/-)-b-Aminoisobutyric acid, AC1Q2B12, 2-Methyl-3-aminopropionic acid, Jsp000532, CHEMBL3544550, H-2-AMINOISOBUTYRIC ACID, CTK8B9844, DL-B-AMINOISOBUTYRIC ACID, 3-azanyl-2-methyl-propanoic acid, DL-3-Aminoisobutyric acid, 98%, (R,S)-3-Amino-2-methylpropanoate, ALBB-026586, DL-3-Amino-2-methylpropanoic acid, 3-amino-2(r,s)methylpropionic acid, DL-2-AMINO-ISO-BUTYRIC ACID, (+/-)-3-Amino-2-methylpropanoate, ANW-63292, CA-443, LMFA01100054, SBB061656, 3-amino-2(R,S)-methylpropionic acid, AKOS003404809, AKOS016843206, AB00933, CS-W013690, HY-W012974, MCULE-5638884438, (+/-)-2-Methyl-3-aminopropanoic acid, 3-AMINO-2-METHYL-PROPIONIC ACID, AK-87760, AK112816, BS-12724, PROPANOIC ACID,3-AMINO-2-METHYL-, SC-10095, AB0009989, AB1002973, AB1003142, LS-184112, TC-152037, A0324, FT-0615042, FT-0749585, R1199, ST45025432, EN300-64468, KS-00001906, C05145, 569A729, A808292, I04-1061, I04-9260, DL-beta-Aminoisobutyric acid, puriss., >=99.0% (NT), Z1723849163, E94C87B1-0A40-4734-863C-16C484E7EE63, null, |A-Methyl-|A-alanine, H-Aib-OH, UNII-T68ALE2O9F, DL-3-Aminoisobutyricacid, C4H9NO2, T68ALE2O9F, (S)-3-amino-2-methylpropanoic acid, Propanoicacid,3-amino-2-methyl-, (R)-3-Amino-2-methylpropanoic acid, C4-H9-N-O2, DL-3-Aminoisobutyric acid hydrate, CID64956, (+-)-3-amino-2-methylpropionic acid, (2R)-3-amino-2-methylpropanoic acid, (2S)-3-amino-2-methylpropanoic acid, A-6050, 4249-19-8, 2140-95-6, 214139-20-5, 62-57-7,

Complexity	72.1
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	103.063g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	103.121g/mol
Monoisotopic Mass	103.063g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	63.3A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	-2.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number