3- (Chloromethyl) phenol

CAT: 1596-AR-P31107-01Size: 10 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-P31107-01Size:10 Units

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CAS Number

60760-06-7

Molecular Formula

C7H7ClO

Molecular Weight

142.58

API Name

Phenol

Chemical Information

3-(Chloromethyl)phenol

CAS Number	60760-06-7
PubChem CID	35683
IUPAC Name	3-(chloromethyl)phenol
Molecular Formula	C7H7ClO
Molecular Weight	142.58
XLogP	1.8
Topological Polar Surface Area	20.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Heavy Atom Count	9
Formal Charge	0
Complexity	85

SMILES

C1=CC(=CC(=C1)O)CCl

InChI

InChI=1S/C7H7ClO/c8-5-6-2-1-3-7(9)4-6/h1-4,9H,5H2

InChIKey

ZFIKJVXBLFGISQ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 60760-06-7

CID: 35683

Formula: C7H7ClO

MW: 142.58

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	142.58
XLogP3	1.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	142.0185425
Monoisotopic Mass	142.0185425
Topological Polar Surface Area	20.2 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	85
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
AR-I04122-01	3-Chloromethyl-Isoquinoline
AR-L01333-01	Methyl2- (chloromethyl) -3-nitrobenzoate
AR-M01160-01	1- (chloromethyl) -3-methylbenzene
AR-N07991-01	3- (Dimethylamino) phenol
AR-P31137-01	Phenol Impurity 3
AR-M02565-01	1,3-Bis (chloromethyl) benzene
AR-M02253-01	1- (chloromethyl) -3- (dichloromethyl) benzene
AR-B06378-01	1- (Chloromethyl) -2,3-Dimethylbenzene
AR-P31165-01	Phenol Related Compound 3
AR-P01637-01	4- (3-chlorobenzoyl) Phenol

Catalog	Name
KCA76006-01	3- (Chloromethyl) phenol
TRC-B424023-1G	3-(Chloromethyl)phenol (>80%)
429436-01	4- (Chloromethyl) -phenol discontinued
OR97145-01	4-[ (Chloromethyl) sulfonyl]phenol
XIA62328-01	4-Chloro-3- (chloromethyl) phenol
TRC-A414800-1G	5-Amino-2-(chloromethyl)-phenol Hydrochloride
sc-267126	4- (5-Chloromethyl-[1,2,4]oxadiazol-3-yl) -phenol
OR1056927-01	4- (5- (Chloromethyl) -1,2,4-oxadiazol-3-yl) phenol
sc-265267	2- (5-Chloromethyl-[1,2,4]oxadiazol-3-yl) -phenol
JRA30446-01	2-[3- (Chloromethyl) -1,2,4-oxadiazol-5-yl]phenol