AG003JCN

1679-51-2 | Cyclohex-3-en-1-ylmethanol

AG003JCN

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CAS Number	1679-51-2
Catalog Number	AG003JCN(AGN-PC-0CR07H)
Chemical Name	Cyclohex-3-en-1-ylmethanol
EC Number	216-847-6
IUPAC Name	cyclohex-3-en-1-ylmethanol
InChI	InChI=1S/C7H12O/c8-6-7-4-2-1-3-5-7/h1-2,7-8H,3-6H2
InChI Key	VEIYJWQZNGASMA-UHFFFAOYSA-N
MDL Number	MFCD00001574
Molecular Formula	C7H12O
Molecular Weight	112.1696
NSC Number	158554
SMILES	OCC1CCC=CC1
Synonyms	Cyclohex-3-en-1-ylmethanol, 3-CYCLOHEXENE-1-METHANOL, 1679-51-2, 4-(Hydroxymethyl)cyclohexene, 3-Cyclohexene-1-carbinol, Cyclohex-3-ene-1-methanol, Cyclohexen-4-ylmethanol, 1,2,3,6-Tetrahydrobenzyl alcohol, 1,2,3,6-Tetrahydrobenzylalcohol, 4-(hydroxymethyl)-1-cyclohexene, VEIYJWQZNGASMA-UHFFFAOYSA-N, 1-(Hydroxymethyl)-3-cyclohexene, EINECS 216-847-6, NSC158554, NSC 158554, 3-cyclohexene methanol, rarechem al bd 0004, 3-cyclohexen-1-methanol, AI3-24787, 4-hydroxymethylcyclohexene, 1-cyclohex-3-enylmethanol, AC1Q7C8D, AC1Q7C8E, cyclohex-3-enylmethan-1-ol, ACMC-1C1I5, DSSTox_CID_24600, DSSTox_RID_80343, DSSTox_GSID_44600, KSC180K7L, 1-Hydroxymethyl-3-cyclohexene, 3-Cyclohexen-1-ylmethanol #, SCHEMBL628623, Cyclohex-3-En-1-Yl-Methanol, (cyclohex-3-en-1-yl)methanol, AC1L261U, Jsp003398, CHEMBL3188995, DTXSID0044600, CTK0I0575, KS-00000NLD, 3-Cyclohexene-1-methanol, 98%, (+/-)-3 cyclohexene-1-methanol, 1,2,5,6-tetrahydrobenzyl alcohol, Tox21_302637, 8571AA, ANW-22321, MFCD00001574, SBB054865, AKOS009031413, MCULE-7843809650, NE10109, NSC-158554, RL02154, RTR-007286, TRA0066639, NCGC00256634-01, AK-63968, AN-49679, SY036929, CAS-1679-51-2, TR-007286, FT-0615564, FT-0618721, ST24046383, EN300-19922, MFCD00001574 (97%), A810925, I14-6379, W-107906, Z1201023038, UNII-94R6Y1S77F, C7H12O, 94R6Y1S77F, C7-H12-O, CID15512, 3-Cyclohexene-1-methanol, 98% 5g, CS-T-13891, C2435, 3-Cyclohexene-1-methanol, 98% - 100G 100g, 101711-78-8,

Complexity	86.4
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	112.089g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	112.172g/mol
Monoisotopic Mass	112.089g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	20.2A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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