AG002DSZ

18962-05-5 | Benzaldehyde, 4-(1-methylethoxy)-

AG002DSZ

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CAS Number	18962-05-5
Catalog Number	AG002DSZ(AGN-PC-0JNPEX)
Chemical Name	Benzaldehyde, 4-(1-methylethoxy)-
IUPAC Name	4-propan-2-yloxybenzaldehyde
InChI	InChI=1S/C10H12O2/c1-8(2)12-10-5-3-9(7-11)4-6-10/h3-8H,1-2H3
InChI Key	WDANSDASCKBVKH-UHFFFAOYSA-N
MDL Number	MFCD00052357
Molecular Formula	C10H12O2
Molecular Weight	164.2011
NSC Number	69072
SMILES	CC(C)OC1=CC=C(C=O)C=C1
Synonyms	4-Isopropoxybenzaldehyde, 18962-05-5, 4-propan-2-yloxybenzaldehyde, Benzaldehyde, 4-(1-methylethoxy)-, 4-(propan-2-yloxy)benzaldehyde, 4-iso-Propoxybenzaldehyde, 4-ISOPROPOXY-1-FORMYLBENZENE, MFCD00052357, WDANSDASCKBVKH-UHFFFAOYSA-N, 4-(Propan-2-Yl-Oxy)Benzaldehyde, 4-(methylethoxy)benzaldehyde, NSC69072, PubChem9651, p-isopropoxybenzaldehyde, 4-isopropoxy-benzaldehyde, AC1Q1QOZ, 4-iso-propyloxybenzaldehyde, 4-isopropyloxy benzaldehyde, ACMC-20a3x9, AC1L5GX0, AC1Q1QP0, 4-(isopropyloxy)benzaldehyde, ASISCHEM R42745, 4-(isopropyloxy)-benzaldehyde, SCHEMBL384361, ZERENEX ZX009703, AC1Q6Q76, 4-(1-methylethoxy)-benzaldehyde, CTK3J3527, KS-00000FVW, RSCBB000894, TIMTEC-BB SBB019521, AKOS UB-606184, DTXSID50290510, AKOS B000275, BUTTPARK 32\08-27, ART-CHEM-BB B000275, ZINC162811, ART-CHEM-BB ACB004214, AKOS 226-45, ALBB-001159, EBD16010, 4-isopropoxybenzaldehyde, AldrichCPR, ANW-56011, BBL028041, NSC-69072, SBB019521, STK346821, AKOS000190485, AS03945, CS-W017902, MCULE-1320703702, RTR-051474, VZ29268, AJ-15948, AK-43945, BC201402, DS-14340, Q026, SC-50124, SY032652, ZB007887, AB0017352, DB-044711, ST4102101, TL8001543, TR-051474, BB 0237064, FT-0085049, FT-0618820, FT-0646973, I0949, EN300-39747, MFCD00052357 (97%), W-6381, A813335, I01-1334, W-201692, F1997-0003, A3424/0145262, 4-Isopropoxybenzaldehyde, 97% 1g, C10H12O2, AR-1G2958, CID250077, 21697-94-9,

Complexity	135
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	164.084g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	164.204g/mol
Monoisotopic Mass	164.084g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.6

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

Lot Number