2-Chloro-5-methoxybenzaldehyde

CAT: 0926-NAA71961-01Size: 10 gDry Ice: NoHazardous: No

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CAT#:0926-NAA71961-01Size:10 g

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CAS Number

13719-61-4

MDL Number

MFCD11845925

Smiles

COC1=CC (=C (C=C1) Cl) C=O

Molecular Formula

C8H7ClO2

Molecular Weight

170.59 g/mol

Controlled

Chemical Information

2-Chloro-5-methoxybenzaldehyde

CAS Number	13719-61-4
PubChem CID	12927838
IUPAC Name	2-chloro-5-methoxybenzaldehyde
Molecular Formula	C8H7ClO2
Molecular Weight	170.59
XLogP	2
Topological Polar Surface Area	26.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	11
Formal Charge	0
Complexity	138

SMILES

COC1=CC(=C(C=C1)Cl)C=O

InChI

InChI=1S/C8H7ClO2/c1-11-7-2-3-8(9)6(4-7)5-10/h2-5H,1H3

InChIKey

FPQKZTTXKWGJRN-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 13719-61-4

CID: 12927838

Formula: C8H7ClO2

MW: 170.59

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	170.59
XLogP3	2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	170.0134572
Monoisotopic Mass	170.0134572
Topological Polar Surface Area	26.3 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	138
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
FC70984-01	5-Chloro-2-methoxybenzaldehyde
WIA62280-01	5-Chloro-2-fluoro-4-methoxybenzaldehyde
ABA29926	3-bromo-5-chloro-2-methoxybenzaldehyde
SLB82833-01	5-Chloro-4-hydroxy-2-methoxybenzaldehyde
QDA11033-01	3-Chloro-2-hydroxy-5-methoxybenzaldehyde
TSA12557	2-Chloro-4-ethoxy-5-methoxybenzaldehyde
SCB28410-01	2-Chloro-4- (cyclopentyloxy) -5-methoxybenzaldehyde
DCA58186	4-Chloro-2-methoxybenzaldehyde
FC157379	2-Chloro-3-methoxybenzaldehyde
JQA85700-01	3-Chloro-4-[ (2-chlorobenzyl) oxy]-5-methoxybenzaldehyde

Catalog	Name
OR53121-01	5-Chloro-2-methoxybenzaldehyde
OR400965-01	2-Chloro-5-methoxybenzaldehyde
OR70077-01	3-Chloro-5-methoxybenzaldehyde
TRC-C611620-250MG	2-Chloro-4-hydroxy-5-methoxybenzaldehyde
OR1099297-01	4-bromo-5-chloro-2-methoxybenzaldehyde
OR1086043-01	2-bromo-5-chloro-4-methoxybenzaldehyde
OR1095549	3-Bromo-5-chloro-2-methoxybenzaldehyde
OR94482	4-Amino-5-chloro-2-methoxybenzaldehyde
sc-233314	5-Chloro-2-hydroxy-3-methoxybenzaldehyde
PC1012704-01	2-chloro-5-fluoro-4-methoxybenzaldehyde