AG006167

67468-65-9 | 4-BENZYLBENZALDEHYDE

AG006167

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CAS Number	67468-65-9
Catalog Number	AG006167(AGN-PC-0JKXCX)
Chemical Name	4-BENZYLBENZALDEHYDE
IUPAC Name	4-benzylbenzaldehyde
InChI	InChI=1S/C14H12O/c15-11-14-8-6-13(7-9-14)10-12-4-2-1-3-5-12/h1-9,11H,10H2
InChI Key	DHARILAASAAGJJ-UHFFFAOYSA-N
MDL Number	MFCD01666418
Molecular Formula	C14H12O
Molecular Weight	196.2445
SMILES	O=CC1=CC=C(CC2=CC=CC=C2)C=C1
Synonyms	4-Benzylbenzaldehyde, 67468-65-9, 4-BENZYL-BENZALDEHYDE, p-Benzylbenzaldehyde, BENZALDEHYDE, p-BENZYL-, BRN 2251443, Benzaldehyde, 4-(phenylmethyl)-, MFCD01666418, AC1L2MJ3, 4-(Phenylmethyl)benzaldehyde, 4-07-00-01406 (Beilstein Handbook Reference), SCHEMBL2222928, Benzaldehyde,4-(phenylmethyl)-, CTK5C6213, DTXSID20217830, DHARILAASAAGJJ-UHFFFAOYSA-N, 4-benzyl-benzaldehyde, AldrichCPR, ZINC1996240, ANW-69057, BBL035904, STL432217, AKOS005255383, MCULE-4516871292, QC-3962, RP04044, AJ-32304, AN-38364, AS-47127, CJ-30818, LS-24922, AB0041953, DB-006667, TC-157802, CS-0060521, FT-0080299, FT-0600832, Y9788, B65206, X-4165, 468B659, J-514489, I14-13969, C14H12O, CID49886, C14-H12-O,

Complexity	186
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	196.089g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	196.249g/mol
Monoisotopic Mass	196.089g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H317
Packing Group
Precautionary statements	P261-P272-P280-P302+P352-P333+P313-P363-P501
UN Code

Certificate of Analysis

Lot Number