AG00IB1D

625120-81-2 | 3-(N-Methylpentylamino)propionic acid, HCl

AG00IB1D

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CAS Number	625120-81-2
Catalog Number	AG00IB1D(AGN-PC-0T4RI6)
Chemical Name	3-(N-Methylpentylamino)propionic acid, HCl
EC Number	613-046-7
IUPAC Name	3-[methyl(pentyl)amino]propanoic acid;hydrochloride
InChI	InChI=1S/C9H19NO2.ClH/c1-3-4-5-7-10(2)8-6-9(11)12;/h3-8H2,1-2H3,(H,11,12);1H
InChI Key	YDWXRULMHQZBEX-UHFFFAOYSA-N
MDL Number	MFCD08275216
Molecular Formula	C9H20ClNO2
Molecular Weight	209.7136
SMILES	O=C(O)CCN(C)CCCCC.[H]Cl
Synonyms	625120-81-2, 3-(methyl(pentyl)amino)propanoic acid hydrochloride, 3-(n-methylpentylamino)propionic acid hydrochloride, 3-(N-Methylpentylamino)propionic acid HCl, 3-(N-Methyl-N-pentylamino)propionic Acid Hydrochloride, 3-[methyl(pentyl)amino]propanoic acid hydrochloride, YDWXRULMHQZBEX-UHFFFAOYSA-N, Ibanic Acid Hydrochloride, 3-(N-Methylpentylamino)propionicacidhydrochloride, Ibandronic Acid Impurity HCl, KSC496M0P, SCHEMBL369126, CTK3J6607, KS-00000FNG, DTXSID20587383, BCP13803, ANW-46132, MFCD08275216, AKOS015900387, CM-1233, RP26528, (R)-4-Benzoxycarbonyl-2-methylpiperazine, AC-25861, AN-27797, AS-15812, Q872, SC-19427, 3-(Methyl(pentyl)amino)propanoic acid HCl, n-methyl-n-pentyl-beta-alaninehydrochloride, 3-(N-Methylpentylamino)propionic acid, HCl, N-Methyl-N-pentyl-|A-alanine Hydrochloride, RT-003118, ST2404823, (3R)-1-Benzyloxycarbonyl-3-methylpiperazine, 3-(N-Methylpentylamino) Propionic Acid HCl, 4CH-018104, FT-0648280, N-methyl-N-pentyl-beta-alanine hydrochloride, b-Alanine, N-methyl-N-pentyl-, hydrochloride, M-2108, 120M812, 3-(N-methylpentylamino)propionic acidhydrochloride, 3-[methyl(pentyl)amino]propanoic acid;hydrochloride, I14-0818, J-510919, 3-(N-Methyl-N-pentylamino)propanoic acid hydrochloride, beta-Alanine, N-methyl-N-pentyl-, hydrochloride (1:1), N-Methyl-N-pentyl-beta-alanine--hydrogen chloride (1/1), Ibandronate Intermediate, C9H20ClNO2, 3- propionicacidhydrochloride, ACN-040770, A8641, 3-(Methyl(pentyl)amino)propanoicacidhydrochloride, 2-methyl-2-(4-trifluoromethyl-phenyl)-propionic acid,

Complexity	126
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	209.118g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	209.714g/mol
Monoisotopic Mass	209.118g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	40.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

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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