(1R,2R)-cyclohexane-1,2-diol, 95%

Name: (1R,2R)-cyclohexane-1,2-diol
Brand: Chempure

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CAS Number

1072-86-2

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IUPAC name	(1R,2R)-cyclohexane-1,2-diol
inchi	InChI=1S/C6H12O2/c7-5-3-1-2-4-6(5)8/h5-8H,1-4H2/t5-,6-/m1/s1
inchi key	PFURGBBHAOXLIO-PHDIDXHHSA-N
molecular formula	C6H12O2
synonyms	trans-1,2-Cyclohexanediol trans-Cyclohexane-1,2-diol 1460-57-7 (1R,2R)-cyclohexane-1,2-diol 1072-86-2
Compound Description	Trans-cyclohexane-1,2-diol is a cyclohexane-1,2-diol with trans-configuration. It is a metabolite of cyclohexene oxide and other such compounds. It has a role as a human xenobiotic metabolite.

Computed Properties

Molecular Weight:	116.16 g/mol
XLogP3:	0.2
Hydrogen Bond Donor Count:	2
Hydrogen Bond Acceptor Count:	2
Rotatable Bond Count:	0
Exact Mass:	116.083729621 g/mol
Monoisotopic Mass:	116.083729621 g/mol
Topological Polar Surface Area:	40.5 Å²
Heavy Atom Count:	8
Formal Charge:	0
Complexity:	62.9
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	2
Undefined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
Covalently-Bonded Unit Count:	1
Compound Is Canonicalized:	Yes

hazard signal	Warning
hazard classes and categories	Skin Irrit. 2 (100%) Eye Irrit. 2A (100%) STOT SE 3 (100%)
precautionary statement codes	P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
hazard statements	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
hazards summary	May cause irritation.

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Product No: AZ2060

(1R,2R)-cyclohexane-1,2-diol, 95%

Product No: AZ2060

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SAFETY AND HAZARDS

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