AG0011NF

13633-25-5 | Benzene, (4-bromobutyl)-

AG0011NF

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CAS Number	13633-25-5
Catalog Number	AG0011NF(AGN-PC-0CRI4L)
Chemical Name	Benzene, (4-bromobutyl)-
IUPAC Name	4-bromobutylbenzene
InChI	InChI=1S/C10H13Br/c11-9-5-4-8-10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9H2
InChI Key	XPBQQAHIVODAIC-UHFFFAOYSA-N
MDL Number	MFCD00154988
Molecular Formula	C10H13Br
Molecular Weight	213.1142
NSC Number	89816
SMILES	BrCCCCC1=CC=CC=C1
Synonyms	1-Bromo-4-phenylbutane, 13633-25-5, (4-Bromobutyl)benzene, 4-Phenylbutyl bromide, 4-bromobutylbenzene, 4-phenyl 1-butyl bromide, 4-Phenyl-1-butyl bromide, 4-Phenyl-1-bromobutane, Benzene, (4-bromobutyl)-, Benzene, (bromobutyl)-, 1-Bromo-4-phenyl-butane, XPBQQAHIVODAIC-UHFFFAOYSA-N, MFCD00154988, NSC89816, 4-phenylbutylbromide, 4-bromo-butylbenzene, zlchem 271, 4-phenyl-butylbromide, 4-Phenyl1-butylbromide, (4-bromobutyl) benzene, 1-phenyl-4-bromobutane, ACMC-1BUIQ, (4-bromo-butyl)-benzene, 4-phenyl-1-bromo butane, (4-Bromobut-1-yl)benzene, AC1L61KP, AC1Q27UK, NCIOpen2_006323, SCHEMBL80789, KSC493S4T, Jsp002197, CTK3J3949, DTXSID10293481, ZLC0089, ACT04260, BCP10383, KS-00000VT4, ZINC1575647, ANW-20027, FC0756, NSC-89816, SBB070790, AKOS005259918, RTC-062105, AC-16206, AJ-27277, AS-12984, CJ-24853, SC-13820, SY036816, AB0005063, DB-042339, ST2402410, TC-062105, 1-Bromo-4-phenylbutane, >=95.0% (GC), FT-0082933, FT-0607515, P1388, MFCD00154988 (95%), K-4354, 633B255, I01-3132, Not Available, (4-bromobutyl)-Benzene, C10H13Br, 1-Bromo-4-phenylbutane, 98% 1g, AR-1G4413, CID259668, ACN-053885, 1-Bromo-4-phenyl-butane, 98% - 25G 25g, 15840-96-7,

Complexity	84.9
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	212.02g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	213.118g/mol
Monoisotopic Mass	212.02g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	0A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H315-H319-H335
Precuationary statements	P261-P305+P351+P338
Siginal words

Certificate of Analysis

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