AG0036J7

7540-51-4 | (S)-(-)-citronellol

AG0036J7

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CAS Number	7540-51-4
Catalog Number	AG0036J7(AGN-PC-0OHN05)
Chemical Name	(S)-(-)-citronellol
EC Number	231-415-7
IUPAC Name	(3S)-3,7-dimethyloct-6-en-1-ol
InChI	InChI=1S/C10H20O/c1-9(2)5-4-6-10(3)7-8-11/h5,10-11H,4,6-8H2,1-3H3/t10-/m0/s1
InChI Key	QMVPMAAFGQKVCJ-JTQLQIEISA-N
MDL Number	MFCD00063214
Molecular Formula	C10H20O
Molecular Weight	156.2652
SMILES	C[C@H](CCO)CCC=C(C)C
UNII	8RSY5Y5658
Synonyms	7540-51-4, (-)-beta-Citronellol, (-)-Citronellol, (S)-(-)-citronellol, (S)-3,7-dimethyloct-6-en-1-ol, beta-Rhodinol, (S)-(-)-3,7-Dimethyl-6-octen-1-ol, (S)-(-)-beta-Citronellol, (S)-citronellol, (-)-3,7-Dimethyloct-6-en-1-ol, (3S)-3,7-dimethyloct-6-en-1-ol, UNII-8RSY5Y5658, l-Citronellol, FEMA No. 2309, 6-Octen-1-ol, 3,7-dimethyl-, (3S)-, MFCD00063214, CHEBI:88, 3S,7-dimethyloct-6-en-1-ol, 8RSY5Y5658, (S)-3,7-Dimethyl-6-octen-1-ol, 6-Octen-1-ol, 3,7-dimethyl-, (S)-, (3S)-citronellol, Citronellol (natural), (S)-(-)-beta-Citronellol, 99%, FG, (3s)-3,7-dimethyl-6-octen-1-ol, CCRIS 7452, EINECS 203-375-0, laevo-citronellol, BRN 1721507, (S) -citronellol, AK-68278, EINECS 231-415-7, AI3-25080, Citronellol (ex. Java citronella oil) (natural), AI3-09552, AC1Q7BST, AC1L1PK9, AC1Q29GQ, (-)-(S)-beta-citronellol, DSSTox_CID_21550, DSSTox_RID_79775, DSSTox_GSID_41550, SCHEMBL301394, CHEMBL1907995, DTXSID1041550, CTK3J3817, KS-00000VHK, QMVPMAAFGQKVCJ-JTQLQIEISA-N, ZINC1532246, Tox21_300711, (S)-(-)-beta-Citronellol, 99%, 1713AC, ANW-61037, AKOS015902396, LMPR0102010012, LS-2078, RTR-030716, NCGC00248147-01, NCGC00254618-01, AC-26774, AJ-26766, AN-20136, CJ-05243, CJ-24178, SC-49208, (-)-beta-Citronellol, analytical standard, CAS-7540-51-4, AX8218718, TR-030716, FT-0604381, C11386, I14-19651, UNII-565OK72VNF component QMVPMAAFGQKVCJ-JTQLQIEISA-N, beta-Citronellol, Citronellol, Rhodinol, Cephrol, Rodinol, Elenol, DL-Citronellol, beta-Citronellol, (S)-, C10H20O, 6-Octen-1-ol, 3,7-dimethyl-, 2,6-Dimethyl-2-octen-8-ol, CID7793, KST-1A8262, NSC 8779, AR-1A4480, C10-H20-O, 3,7-DIMETHYL-6-OCTEN-1-OL, 6-Octen-1-ol, 3,7-dimethyl-, (-)-, C1466, C2254, (S)-(-)-beta-Citronellol, 97% - 5G 5g, ( - ) - 3,7 - dimethyloct - 6 - en - 1 - ol, 106-22-9, 79239-83-1,

Complexity	112
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	156.151g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	156.269g/mol
Monoisotopic Mass	156.151g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	20.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H317-H319
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number