3-(Bromomethyl)benzyl Alcohol - CAS 82072-22-8

Catalog:	BB036748
Product Name:	3-(Bromomethyl)benzyl Alcohol
CAS:	82072-22-8
Synonyms:	[3-(bromomethyl)phenyl]methanol; [3-(bromomethyl)phenyl]methanol

Technical Data

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Computed Properties

IUPAC Name:	[3-(bromomethyl)phenyl]methanol
Description:	3-(Bromomethyl)benzyl Alcohol (CAS# 82072-22-8) is a useful research chemical.
Molecular Weight:	201.06
Molecular Formula:	C8H9BrO
Canonical SMILES:	C1=CC(=CC(=C1)CBr)CO
InChI:	InChI=1S/C8H9BrO/c9-5-7-2-1-3-8(4-7)6-10/h1-4,10H,5-6H2
InChI Key:	JQZKOBFRLUVZLO-UHFFFAOYSA-N
MDL:	MFCD08234488
LogP:	2.07380

Publication Number	Title	Priority Date
TW-202002975-A	Matrix metalloproteinase (MMP) inhibitors and methods of use thereof	20180515
US-2019352288-A1	Matrix metalloproteinase (mmp) inhibitors and methods of use thereof	20180515
WO-2019222154-A1	Matrix metalloproteinase (mmp) inhibitors and methods of use thereof	20180515
AU-2019269409-A1	Matrix metalloproteinase (MMP) inhibitors and methods of use thereof	20180515
CN-112424186-A	Matrix Metalloproteinase (MMP) inhibitors and methods of use thereof	20180515

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Complexity:	95.3
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	199.98368
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	199.98368
Rotatable Bond Count:	2
Topological Polar Surface Area:	20.2
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.8