AG008S2V

109347-40-2 | (3-BROMOPHENYL)ACETALDEHYDE

AG008S2V

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CAS Number	109347-40-2
Catalog Number	AG008S2V(AGN-PC-02SSYC)
Chemical Name	(3-BROMOPHENYL)ACETALDEHYDE
IUPAC Name	2-(3-bromophenyl)acetaldehyde
InChI	InChI=1S/C8H7BrO/c9-8-3-1-2-7(6-8)4-5-10/h1-3,5-6H,4H2
InChI Key	GQPCWVVXGHFKQY-UHFFFAOYSA-N
MDL Number	MFCD02261727
Molecular Formula	C8H7BrO
Molecular Weight	199.0446
SMILES	BrC1=CC=CC(CC=O)=C1
Synonyms	2-(3-Bromophenyl)acetaldehyde, 109347-40-2, (3-Bromophenyl)acetaldehyde, Benzeneacetaldehyde,3-bromo-, ACMC-1BPEH, 3-Bromobenzeneacetaldehyde, 3-bromo-phenylacetaldehyde, 2-(3-bromophenyl)ethanal, (3-bromophenyl)-acetaldehyde, SCHEMBL689563, (3-Bromo-phenyl)-acetaldehyde, CTK4A6462, DTXSID30606559, GQPCWVVXGHFKQY-UHFFFAOYSA-N, ZINC2581068, ANW-66638, SBB052204, AKOS012322385, AB11787, NE53777, RP04190, AJ-42970, SC-12845, TC-155383, CS-0038245, Y7020, W-204715, C8H7BrO,

Complexity	114
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	197.968g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	199.047g/mol
Monoisotopic Mass	197.968g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P264-P302+P352-P304+P340-P305+P351+P338-P332+P313-P337+P313
UN Code

Certificate of Analysis

Lot Number