AG00G74W

856563-08-1 | (S)-3-(1-Aminoethyl)phenol hcl

AG00G74W

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CAS Number	856563-08-1
Catalog Number	AG00G74W(AGN-PC-0OK0CF)
Chemical Name	(S)-3-(1-Aminoethyl)phenol hcl
IUPAC Name	3-[(1R)-1-aminoethyl]phenol;hydrochloride
InChI	InChI=1S/C8H11NO.ClH/c1-6(9)7-3-2-4-8(10)5-7;/h2-6,10H,9H2,1H3;1H/t6-;/m1./s1
InChI Key	INBKHDKLDOGKKN-FYZOBXCZSA-N
MDL Number	MFCD11044547
Molecular Formula	C8H12ClNO
Molecular Weight	173.6400
SMILES	OC1=CC=CC([C@H](N)C)=C1.[H]Cl
Synonyms	(R)-3-(1-AMINOETHYL)PHENOL HYDROCHLORIDE, 856563-08-1, (R)-3-(1-AMINOETHYL)PHENOL HCL, AK-77840, KS-00000LLD, MFCD11044547, AKOS022183364, DS-17246, 3-(1-aminoethyl)phenol,hydrochloride,

Complexity	105
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	173.061g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	173.64g/mol
Monoisotopic Mass	173.061g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	46.2A^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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