AG005ZRI

6940-80-3 | N-BENZYL-L-ALANINOL

AG005ZRI

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CAS Number	6940-80-3
Catalog Number	AG005ZRI(AGN-PC-0OGRGG)
Chemical Name	N-BENZYL-L-ALANINOL
IUPAC Name	(2S)-2-(benzylamino)propan-1-ol
InChI	InChI=1S/C10H15NO/c1-9(8-12)11-7-10-5-3-2-4-6-10/h2-6,9,11-12H,7-8H2,1H3/t9-/m0/s1
InChI Key	PJXWCRXOPLGFLX-VIFPVBQESA-N
MDL Number	MFCD03840382
Molecular Formula	C10H15NO
Molecular Weight	165.2322
NSC Number	60401
SMILES	C[C@H](NCC1=CC=CC=C1)CO
Synonyms	(S)-2-(Benzylamino)propan-1-ol, 6940-80-3, N-BENZYL-L-ALANINOL, (2S)-2-(benzylamino)propan-1-ol, 1-Propanol, 2-[(phenylmethyl)amino]-, (2S)-, (2s)-2-[benzylamino]propan-1-ol, NSC60401, AC1NS9BX, SCHEMBL1189292, (2S)-2-benzylamino-1-propanol, CTK5C9723, KS-00000GRJ, (S)-2-Benzylamino-propan-1-ol, DTXSID70418133, PJXWCRXOPLGFLX-VIFPVBQESA-N, CS-M1051, ZINC4742824, MFCD03840382, NSC-60401, AKOS006275865, DS-5748, AJ-52124, (2S)-2-[(phenylmethyl)amino]-1-propanol, Z3519, 1-Propanol,2-[(phenylmethyl)amino]-,(2S)-, 1-Propanol,2-[(phenylmethyl)amino]-, (2S)-, I01-8663, C10H15NO, CID5356540, (S)-2-(benzylamino)propan-1-ol, 95% - 1G 1g,

Complexity	110
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	165.115g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	165.236g/mol
Monoisotopic Mass	165.115g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	32.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H302-H315-H319-H335
Precuationary statements	P261-P305+P351+P338
Siginal words

Certificate of Analysis

Lot Number