AG003HBP

867-84-5 | 2-Fluoro-beta-alanine HCl

AG003HBP

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CAS Number	867-84-5
Catalog Number	AG003HBP(AGN-PC-0782DP)
Chemical Name	2-Fluoro-beta-alanine HCl
IUPAC Name	3-amino-2-fluoropropanoic acid;hydrochloride
InChI	InChI=1S/C3H6FNO2.ClH/c4-2(1-5)3(6)7;/h2H,1,5H2,(H,6,7);1H
InChI Key	CVYOZQFAVJXJTK-UHFFFAOYSA-N
MDL Number	MFCD00060202
Molecular Formula	C3H7ClFNO2
Molecular Weight	143.5446
SMILES	O=C(O)C(F)CN.[H]Cl
Synonyms	867-84-5, 2-Fluoro-beta-alanine Hydrochloride, 3-amino-2-fluoropropanoic acid hydrochloride, 2-Fluoro-B-alanine hydrochloride, Propanoic acid, 3-amino-2-fluoro-, hydrochloride, (r)-3-amino-2-fluoropropanoic acid hcl, (s)-3-amino-2-fluoropropanoic acid hcl, ACMC-209qbg, 2-Fluoro-beta-alanine HCl, SCHEMBL1565636, CTK8B2490, ANW-38378, MFCD00060202, AKOS006222509, TC-127123, 3-Amino-2-fluoropropionic Acid Hydrochloride, F0185, FT-0748618, Z2238508658, (2S)-3-AMINO-2-FLUOROPROPANOIC ACID HYDROCHLORIDE, 1414874-20-6, C3H6FNO2.ClH, C3-H6-F-N-O2.Cl-H, Fluoro-beta-alanine hydrochloride, 3-Amino-2-fluoro-propanoic acid Hydrochloride, beta-ALANINE, 2-FLUORO-, HYDROCHLORIDE, (2R)-3-amino-2-fluoropropanoic acid hydrochloride, 1414874-23-9,

Complexity	75.3
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	143.015g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	143.542g/mol
Monoisotopic Mass	143.015g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	63.3A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302+H312+H332
Packing Group
Precautionary statements	P261-P264-P270-P271-P280-P301+P312+P330-P302+P352+P312+P362+P364-P304+P340+P312-P501
UN Code

Certificate of Analysis

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