AG003BCL

2385-77-5 | (3R)-3,7-dimethyloct-6-enal

AG003BCL

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CAS Number	2385-77-5
Catalog Number	AG003BCL(AGN-PC-0O84T8)
Chemical Name	(3R)-3,7-dimethyloct-6-enal
EC Number	219-194-5
IUPAC Name	(3R)-3,7-dimethyloct-6-enal
InChI	InChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,8,10H,4,6-7H2,1-3H3/t10-/m1/s1
InChI Key	NEHNMFOYXAPHSD-SNVBAGLBSA-N
MDL Number	MFCD00012781
Molecular Formula	C10H18O
Molecular Weight	154.2493
SMILES	[C@@H](CCC=C(C)C)(CC=O)C
Synonyms	(R)-(+)-Citronellal, (+)-Citronellal, 2385-77-5, (R)-3,7-Dimethyloct-6-enal, (3R)-3,7-dimethyloct-6-enal, (3R)-(+)-citronellal, (R)-citronellal, (3R)-3,7-Dimethyl-6-octenal, 6-Octenal, 3,7-dimethyl-, (3R)-, (R)-3,7-dimethyl-6-octenal, 6-Octenal, 3,7-dimethyl-, (R)-, CHEBI:299, R-3,7-dimethyl-oct-6-enal, NEHNMFOYXAPHSD-SNVBAGLBSA-N, d-citronellal, L-Citronellal, ()-Citronellal, Citronellol 96%, Citronella Java Oil, EINECS 219-194-5, s-(-)-citronellal, L-(-)-Citronellal, AC1L2OQO, EC 219-194-5, AC1Q29GL, AC1Q29GM, AC1Q6PO2, SCHEMBL457495, 7-dimethyl-(theta)-6-octena, 3,7-Dimethyl-(S)-6-Octenal, CHEMBL1081721, DTXSID6044482, (r)-3,7-dimethyl-oct-6-enal, CTK8F2012, 3,7-Dimethyl-(3R)-6-Octenal, 3,7-Dimethyl-(3S)-6-Octenal, 6-octenal,3,7-dimethyl-,(r)-, ZINC1531600, 6-octenal,3,7-dimethyl-,(3r)-, 3,7-Dimethyl-6-octenal, (3R)-, MFCD00067089, (R)-(+)-3,7-Dimethyl-6-octenal, 6-Octenal,3,7-dimethyl-, (3R)-, AKOS025311453, CCG-214393, LMPR0102010007, 6-Octenal, 3,7-dimethyl-, (theta)-, CJ-24100, HY-111664, CS-0089462, FT-0604386, FT-0699573, (R)-(+)-Citronellal, technical grade, 90%, C09848, A801397, UNII-QB99VZZ7GZ component NEHNMFOYXAPHSD-SNVBAGLBSA-N, (3R)-3,7-Dimethyloct-6-enal (6-Octenal, 3,7-dimethyl-, (3R)-), Rhodinal, CITRONELLAL, (S)-citronellal, (3S)-(-)-Citronellal, C10H18O, (S)-3,7-Dimethyloct-6-enal, KST-1A3079, CID75427, AR-1A0143, C10-H18-O, 106-23-0, 24437-41-0,

Complexity	132
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	154.136g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	154.253g/mol
Monoisotopic Mass	154.136g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
Signal Words	warning
UN Code

Certificate of Analysis

Lot Number