AG002BGN

19835-38-2 | Tricyclo[3.3.1.13,7]decane-1-acetyl chloride

AG002BGN

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CAS Number	19835-38-2
Catalog Number	AG002BGN(AGN-PC-0KKUF9)
Chemical Name	Tricyclo[3.3.1.13,7]decane-1-acetyl chloride
IUPAC Name	2-(1-adamantyl)acetyl chloride
InChI	InChI=1S/C12H17ClO/c13-11(14)7-12-4-8-1-9(5-12)3-10(2-8)6-12/h8-10H,1-7H2
InChI Key	HLQSEJBREPQBRW-UHFFFAOYSA-N
MDL Number	MFCD00277670
Molecular Formula	C12H17ClO
Molecular Weight	212.7158
SMILES	O=C(Cl)CC12CC3CC(C2)CC(C3)C1
Synonyms	1-ADAMANTANEACETYL CHLORIDE, 19835-38-2, 1-adamantylacetyl chloride, 1-Adamantaneacetylchloride, 1-adamantylacetic acid chloride, 2-(1-adamantyl)acetyl chloride, 1-adamantaneacetic acid chloride, 2-(adamantan-1-yl)acetyl chloride, Tricyclo[3.3.1.13,7]decane-1-acetyl chloride, PubChem8843, AC1MCKMG, adamantaneacetyl chloride, 1-adamantane acetyl chloride, (1-adamantyl)acetyl chloride, adamant-1-yl acetyl chloride, (1-adamantyl) acetyl chloride, adamantan-1-yl-acetyl chloride, SCHEMBL1074062, (1-adamantyl ) acetyl chloride, (adamantan-1-yl)acetyl chloride, CTK0H3740, KS-00000AWV, 2-(adamant-1-yl)acetyl chloride, DTXSID20378137, HLQSEJBREPQBRW-UHFFFAOYSA-N, ALBB-011188, ZINC2565083, BBL014850, GEO-03097, MFCD00277670, RW3390, STL197259, AKOS004120226, AKOS016015218, MCULE-4168133705, QC-2766, TRA0005826, AS-31303, CJ-09696, CS-11372, SC-72414, SY017711, AB0032366, DB-005075, TC-030136, FT-0084737, FT-0600233, A20736, Z-4421, MFCD00277670 (95+%), 835A382, tricyclo[3.3.1.1~3,7~]dec-1-ylacetyl chloride, I14-9371, tricyclo[3.3.1.1~3,7~]decane-1-acetyl chloride, ZINC02565083, CID2771882, 1-Adamantylacetyl chloride, 98% - 1G 1g,

Complexity	230
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	212.097g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	212.717g/mol
Monoisotopic Mass	212.097g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H317-H319
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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