AG001R88

1596-64-1 | (S)-2-Amino-3-(1h-imidazol-5-yl)propan-1-ol hcl

AG001R88

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CAS Number	1596-64-1
Catalog Number	AG001R88(AGN-PC-0Q7PZG)
Chemical Name	(S)-2-Amino-3-(1h-imidazol-5-yl)propan-1-ol hcl
EC Number	216-482-2
IUPAC Name	(2S)-2-amino-3-(1H-imidazol-5-yl)propan-1-ol;dihydrochloride
InChI	InChI=1S/C6H11N3O.2ClH/c7-5(3-10)1-6-2-8-4-9-6;;/h2,4-5,10H,1,3,7H2,(H,8,9);2*1H/t5-;;/m0../s1
InChI Key	FRCAFNBBXRWXQA-XRIGFGBMSA-N
MDL Number	MFCD00078058
Molecular Formula	C6H13Cl2N3O
Molecular Weight	214.0929
SMILES	N[C@@H](CC1=CNC=N1)CO.[H]Cl.[H]Cl
Synonyms	L-Histidinol dihydrochloride, 1596-64-1, l-histidinol 2 hcl, beta-Aminoimidazole-4-propanol dihydrochloride, L-(-)-Histidinol dihydrochloride, EINECS 216-482-2, (S)-2-Amino-3-(4-imidazolyl)propanol dihydrochloride, L(-)-Histidinol 2HCl, (S)-2-Amino-3-(1H-imidazol-4-yl)propan-1-ol dihydrochloride, Imidazole-4-propanol, beta-amino-, dihydrochloride, (S)-beta-Amino-1H-imidazole-4-propanol dihydrochloride, MFCD00078058, 1H-Imidazole-4-propanol, beta-amino-, dihydrochloride, (S)- (9CI), H-2500, (2S)-2-amino-3-(1H-imidazol-4-yl)propan-1-ol dihydrochloride, L(-)-Histidinol dihydrochloride, 99%, FRCAFNBBXRWXQA-XRIGFGBMSA-N, h-his-ol 2hcl, (S)-2-AMINO-3-(1H-IMIDAZOL-5-YL)PROPAN-1-OL HCL, L-Histidinol DiHCl, histidinol dihydrochloride, bmse000448, AC1L53XK, SCHEMBL2933, C6H11N3O.2HCl, histidinol dihydrochloride, l-, CTK8B8567, BIB6064, ZX-AFC000388, 1H-Imidazole-4-propanol, beta-amino-, dihydrochloride, (S)-, ANW-60721, CH-110, AKOS015962348, ACM1596641, API0003169, GS-6659, KS-000026C8, AC-16617, AK-81268, LS-78879, SC-25916, AX8018657, L-Histidinol dihydrochloride, >=98 (TLC), TC-149466, FT-0627843, ST50320032, 596H641, l-beta-amino-1h-imidazole-4-propanol dihydrochloride, (l)-2-amino-3-(4-imidazolyl)propanol dihydrochloride, Z2697164739, (2S)-2-amino-3-(1H-imidazol-5-yl)propan-1-ol dihydrochloride, (2S)-2-amino-3-imidazol-4-ylpropan-1-ol, chloride, chloride, 1H-Imidazole-5-propanol, beta-amino-, hydrochloride (1:2), (betaS)-, Dihydrochloride, L-Histidinoldihydrochloride, L-Histidine dihydrochloride, C6H11H3O.2ClH, C6H11N3O.2ClH, C6-H11-H3-O.2Cl-H, CID197743, ACN-033277, |A-Aminoimidazole-4-propanol dihydrochloride, (2S)-2-amino-3-(1H-imidazol-5-yl)propan-1-ol,

Complexity	99
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	3
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	213.044g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	5
Isotope Atom Count	0
Molecular Weight	214.09g/mol
Monoisotopic Mass	213.044g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	74.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

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

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